KEGG   COMPOUND: C00123
Entry
C00123                      Compound                               
Name
L-Leucine;
2-Amino-4-methylvaleric acid;
(2S)-alpha-2-Amino-4-methylvaleric acid;
(2S)-alpha-Leucine
Formula
C6H13NO2
Exact mass
131.0946
Mol weight
131.17
Structure
Remark
Same as: D00030
Reaction
R01088 R01089 R01090 R01091 R02552 R03657 R08411 R08664
R10944
Pathway
map00280  Valine, leucine and isoleucine degradation
map00290  Valine, leucine and isoleucine biosynthesis
map00966  Glucosinolate biosynthesis
map00970  Aminoacyl-tRNA biosynthesis
map01060  Biosynthesis of plant secondary metabolites
map01065  Biosynthesis of alkaloids derived from histidine and purine
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
map02010  ABC transporters
map04150  mTOR signaling pathway
map04974  Protein digestion and absorption
map04978  Mineral absorption
map05131  Shigellosis
map05230  Central carbon metabolism in cancer
Module
M00036  Leucine degradation, leucine => acetoacetate + acetyl-CoA
Network
nt06024  Valine, leucine and isoleucine degradation
Enzyme
1.4.1.9         1.14.13.-       2.3.1.66        2.6.1.6         
2.6.1.42        2.6.1.67        3.5.1.64        5.4.3.7         
6.1.1.4         6.3.2.47
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Common amino acids
    C00123  Leucine (Leu)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   L-Leucine
    D00030  Leucine (USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00030  L-Leucine
Other DBs
CAS: 61-90-5
PubChem: 3423
ChEBI: 15603
KNApSAcK: C00001377
PDB-CCD: LEU[PDBj]
NIKKAJI: J1.167C
LinkDB
KCF data

ATOM        9
            1   C1c C    25.0761  -19.4138
            2   C1b C    26.2633  -18.6769
            3   C6a C    23.8420  -18.7586
            4   N1a N    25.1229  -20.8173
            5   C1c C    27.4974  -19.3377
            6   O6a O    22.6841  -19.5483
            7   O6a O    23.8654  -17.3551
            8   C1a C    28.6846  -18.6007
            9   C1a C    27.5442  -20.7356
BOND        8
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     3   6 1
            6     3   7 2
            7     5   8 1
            8     5   9 1

» Japanese version

KEGG   COMPOUND: C00407
Entry
C00407                      Compound                               
Name
L-Isoleucine;
2-Amino-3-methylvaleric acid
Formula
C6H13NO2
Exact mass
131.0946
Mol weight
131.17
Structure
Remark
Same as: D00065
Reaction
R02196 R02197 R02199 R02200 R03656 R06726 R09344 R09403
R10027 R10723 R10943 R11078 R11723 R12650
Pathway
map00280  Valine, leucine and isoleucine degradation
map00290  Valine, leucine and isoleucine biosynthesis
map00460  Cyanoamino acid metabolism
map00960  Tropane, piperidine and pyridine alkaloid biosynthesis
map00966  Glucosinolate biosynthesis
map00970  Aminoacyl-tRNA biosynthesis
map01060  Biosynthesis of plant secondary metabolites
map01064  Biosynthesis of alkaloids derived from ornithine, lysine and nicotinic acid
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
map02010  ABC transporters
map04974  Protein digestion and absorption
map04978  Mineral absorption
map05131  Shigellosis
map05230  Central carbon metabolism in cancer
Module
M00019  Valine/isoleucine biosynthesis, pyruvate => valine / 2-oxobutanoate => isoleucine
M00570  Isoleucine biosynthesis, threonine => 2-oxobutanoate => isoleucine
Network
nt06024  Valine, leucine and isoleucine degradation
Enzyme
1.4.1.9         1.4.3.2         1.14.11.45      1.14.11.74      
1.14.14.38      1.14.14.39      2.6.1.32        2.6.1.42        
5.1.1.21        6.1.1.5         6.3.2.47        6.3.2.50
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Common amino acids
    C00407  Isoleucine (Ile)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   L-Isoleucine
    D00065  Isoleucine (USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00065  L-Isoleucine
Other DBs
CAS: 73-32-5
PubChem: 3697
ChEBI: 17191
KNApSAcK: C00001374
PDB-CCD: ILE[PDBj]
NIKKAJI: J2.818E
LinkDB
KCF data

ATOM        9
            1   C1c C    22.4922  -17.1397
            2   C1c C    23.6796  -16.4029
            3   C6a C    21.2581  -16.4789
            4   N1a N    22.5391  -18.5377
            5   C1b C    24.9137  -17.0637
            6   C1a C    23.6387  -15.0049
            7   O6a O    20.1001  -17.2742
            8   O6a O    21.2815  -15.0809
            9   C1a C    26.1069  -16.3268
BOND        8
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     3   8 2
            8     5   9 1

» Japanese version

KEGG   COMPOUND: C00079
Entry
C00079                      Compound                               
Name
L-Phenylalanine;
(S)-alpha-Amino-beta-phenylpropionic acid
Formula
C9H11NO2
Exact mass
165.0790
Mol weight
165.19
Structure
Remark
Same as: D00021
Reaction
R00686 R00688 R00689 R00690 R00691 R00692 R00693 R00694
R00695 R00697 R00698 R00699 R01375 R01376 R01795 R03660
R06744 R07211 R08463 R08652 R08690 R09535 R09578 R09579
R10286 R10287 R10495 R10499 R10729 R11068 R11918 R12413
R12540 R12543
Pathway
map00360  Phenylalanine metabolism
map00400  Phenylalanine, tyrosine and tryptophan biosynthesis
map00460  Cyanoamino acid metabolism
map00470  D-Amino acid metabolism
map00940  Phenylpropanoid biosynthesis
map00960  Tropane, piperidine and pyridine alkaloid biosynthesis
map00966  Glucosinolate biosynthesis
map00970  Aminoacyl-tRNA biosynthesis
map00996  Biosynthesis of various alkaloids
map00997  Biosynthesis of various other secondary metabolites
map00999  Biosynthesis of various plant secondary metabolites
map01060  Biosynthesis of plant secondary metabolites
map01061  Biosynthesis of phenylpropanoids
map01063  Biosynthesis of alkaloids derived from shikimate pathway
map01064  Biosynthesis of alkaloids derived from ornithine, lysine and nicotinic acid
map01070  Biosynthesis of plant hormones
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
map02010  ABC transporters
map04974  Protein digestion and absorption
map04978  Mineral absorption
map05230  Central carbon metabolism in cancer
Module
M00024  Phenylalanine biosynthesis, chorismate => phenylpyruvate => phenylalanine
M00039  Monolignol biosynthesis, phenylalanine/tyrosine => monolignol
M00137  Flavanone biosynthesis, phenylalanine => naringenin
M00891  Ditryptophenaline biosynthesis, tryptophan + phenylalanine => ditryptophenaline
M00910  Phenylalanine biosynthesis, chorismate => arogenate => phenylalanine
Network
nt06016  Phenylalanine and tyrosine metabolism
Enzyme
1.4.1.20        1.4.3.2         1.11.1.21       1.13.12.9       
1.14.14.40      1.14.16.1       1.14.16.7       2.3.1.53        
2.6.1.1         2.6.1.5         2.6.1.9         2.6.1.28        
2.6.1.57        2.6.1.58        2.6.1.64        2.6.1.70        
2.6.1.-         3.4.17.23       4.1.1.28        4.1.1.53        
4.1.1.109       4.2.1.51        4.2.1.91        4.3.1.24        
4.3.1.25        5.1.1.11        5.4.3.10        5.4.3.11        
6.1.1.20        6.3.2.40        6.3.2.-
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Common amino acids
    C00079  Phenylalanine (Phe)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   L-Phenylalanine
    D00021  Phenylalanine (USP/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00021  L-Phenylalanine
Other DBs
CAS: 63-91-2
PubChem: 3379
ChEBI: 17295
KNApSAcK: C00001386
PDB-CCD: PHE[PDBj]
NIKKAJI: J9.175H
LinkDB
KCF data

ATOM        12
            1   C8y C    25.3400  -16.0300
            2   C8x C    25.3400  -17.5000
            3   C8x C    24.0800  -18.2000
            4   C8x C    22.8900  -17.5000
            5   C8x C    22.8900  -16.0300
            6   C8x C    24.0800  -15.3300
            7   C1b C    26.5300  -15.3300
            8   C1c C    27.7200  -16.0300
            9   C6a C    28.9100  -15.3300
            10  O6a O    30.1000  -16.0300
            11  O6a O    28.9100  -13.9300
            12  N1a N    27.7200  -17.5000
BOND        12
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    9  11 2
            12    8  12 1 #Up

» Japanese version

KEGG   COMPOUND: C00073
Entry
C00073                      Compound                               
Name
L-Methionine;
Methionine;
L-2-Amino-4methylthiobutyric acid
Formula
C5H11NO2S
Exact mass
149.0511
Mol weight
149.21
Structure
Remark
Same as: D00019
Reaction
R00177 R00648 R00649 R00650 R00651 R00652 R00653 R00654
R00655 R00656 R00657 R00946 R01078 R02025 R02821 R03472
R03659 R04153 R04405 R04710 R06268 R06269 R06270 R06895
R07396 R07606 R07608 R07767 R08583 R08588 R08618 R08635
R08862 R08873 R08875 R08893 R09373 R09394 R09637 R09639
R10204 R10220 R10246 R10430 R10437 R10552 R10645 R10646
R10649 R10650 R10652 R10667 R11063 R11112 R11274 R11275
R11293 R11294 R11484 R11700 R11710 R11919 R12002 R12055
R12098 R12161 R12162 R12238 R12239 R12423 R12424 R12497
R12507 R12569 R12724 R12750 R12788 R13130 R13131 R13180
R13357 R13358 R13373 R13375
 » show all
Pathway
map00270  Cysteine and methionine metabolism
map00470  D-Amino acid metabolism
map00966  Glucosinolate biosynthesis
map00970  Aminoacyl-tRNA biosynthesis
map00999  Biosynthesis of various plant secondary metabolites
map01060  Biosynthesis of plant secondary metabolites
map01070  Biosynthesis of plant hormones
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
map01240  Biosynthesis of cofactors
map01523  Antifolate resistance
map04148  Efferocytosis
map04974  Protein digestion and absorption
map04978  Mineral absorption
map04980  Cobalamin transport and metabolism
map05230  Central carbon metabolism in cancer
Module
M00017  Methionine biosynthesis, aspartate => homoserine => methionine
M00034  Methionine salvage pathway
M00035  Methionine degradation
M00368  Ethylene biosynthesis, methionine => ethylene
M00609  Cysteine biosynthesis, methionine => cysteine
M00953  Mugineic acid biosynthesis, methionine => 3-epihydroxymugineic acid
Network
nt06030  Methionine metabolism
Enzyme
1.1.98.7        1.1.99.38       1.3.98.3        1.3.98.6        
1.3.98.7        1.4.3.2         1.8.4.11        1.8.4.13        
1.8.4.14        1.17.98.2       1.21.98.1       1.21.98.3       
1.21.98.5       1.97.1.4        2.1.1.3         2.1.1.5         
2.1.1.10        2.1.1.12        2.1.1.13        2.1.1.14        
2.1.1.280       2.1.1.308       2.1.1.326       2.1.1.342       
2.1.1.350       2.1.1.379       2.1.1.390       2.1.1.394       
2.1.1.-         2.4.99.17       2.5.1.6         2.5.1.49        
2.5.1.63        2.5.1.94        2.5.1.120       2.5.1.147       
2.6.1.5         2.6.1.57        2.6.1.73        2.6.1.88        
2.6.1.117       2.6.1.-         2.8.1.6         2.8.1.8         
2.8.4.3         2.8.4.4         2.8.4.5         3.4.13.12       
3.5.1.31        3.13.2.3        4.1.1.57        4.1.3.44        
4.1.99.17       4.1.99.19       4.1.99.22       4.1.99.23       
4.1.99.26       4.3.1.30        4.3.1.32        4.4.1.11        
4.7.1.1         5.1.1.2         5.3.99.13       6.1.1.10
 » show all
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Common amino acids
    C00073  Methionine (Met)
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 V VARIOUS
  V03 ALL OTHER THERAPEUTIC PRODUCTS
   V03A ALL OTHER THERAPEUTIC PRODUCTS
    V03AB Antidotes
     V03AB26 Methionine
      D00019  Methionine (USP)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Methionine
    D00019  Methionine (USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00019  L-Methionine
Other DBs
CAS: 63-68-3
PubChem: 3373
ChEBI: 16643
KNApSAcK: C00001379
PDB-CCD: MET[PDBj]
NIKKAJI: J9.174J
LinkDB
KCF data

ATOM        9
            1   C1c C    24.5047  -19.4197
            2   C6a C    23.3598  -18.6719
            3   C1b C    25.7313  -18.7361
            4   N1a N    24.5455  -20.8273
            5   O6a O    22.1332  -19.3553
            6   O6a O    23.3772  -17.2641
            7   C1b C    26.9405  -19.4546
            8   S2a S    28.1672  -18.7712
            9   C1a C    29.3647  -19.4896
BOND        8
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     7   8 1
            8     8   9 1

» Japanese version

KEGG   COMPOUND: C00135
Entry
C00135                      Compound                               
Name
L-Histidine;
(S)-alpha-Amino-1H-imidazole-4-propionic acid
Formula
C6H9N3O2
Exact mass
155.0695
Mol weight
155.15
Structure
Remark
Same as: D00032
Reaction
R01158 R01159 R01160 R01161 R01163 R01164 R01166 R01167
R01168 R01169 R01991 R01992 R03655 R08412 R08413 R10523
R10686 R11015 R12313 R12436
Pathway
map00340  Histidine metabolism
map00404  Staurosporine biosynthesis
map00410  beta-Alanine metabolism
map00470  D-Amino acid metabolism
map00970  Aminoacyl-tRNA biosynthesis
map01060  Biosynthesis of plant secondary metabolites
map01065  Biosynthesis of alkaloids derived from histidine and purine
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01230  Biosynthesis of amino acids
map02010  ABC transporters
map04974  Protein digestion and absorption
map05230  Central carbon metabolism in cancer
Module
M00026  Histidine biosynthesis, PRPP => histidine
M00045  Histidine degradation, histidine => N-formiminoglutamate => glutamate
M00949  Staphylopine biosynthesis, L-histidine => staphylopine
Network
nt06037  Histidine metabolism
Enzyme
1.1.1.23        1.14.99.52      2.1.1.44        2.1.1.-         
2.3.1.33        2.6.1.38        3.4.13.18       3.4.13.20       
4.1.1.22        4.3.1.3         5.1.1.24        6.1.1.21        
6.3.2.11        6.3.2.-
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Common amino acids
    C00135  Histidine (His)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   L-Histidine
    D00032  Histidine (USP/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00032  L-Histidine
  D00032  L-Histidine hydrochloride hydrate
Other DBs
CAS: 71-00-1
PubChem: 3435
ChEBI: 15971
KNApSAcK: C00001363
PDB-CCD: HIS[PDBj]
NIKKAJI: J4.881J
LinkDB
KCF data

ATOM        11
            1   C8x C    24.1997  -18.0246
            2   N5x N    24.6612  -19.3463
            3   C8y C    26.0609  -19.3157
            4   C8x C    26.4644  -17.9751
            5   N4x N    25.3141  -17.1771
            6   C1b C    27.2524  -20.0200
            7   C1c C    28.4649  -19.3200
            8   C6a C    29.6773  -20.0200
            9   O6a O    30.8897  -19.3200
            10  O6a O    29.6773  -21.4200
            11  N1a N    28.4649  -17.9202
BOND        11
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     1   5 1
            6     3   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    8  10 2
            11    7  11 1 #Down

» Japanese version

KEGG   COMPOUND: C00078
Entry
C00078                      Compound                               
Name
L-Tryptophan;
Tryptophan;
(S)-alpha-Amino-beta-(3-indolyl)-propionic acid
Formula
C11H12N2O2
Exact mass
204.0899
Mol weight
204.22
Structure
Remark
Same as: D00020
Reaction
R00673 R00674 R00675 R00676 R00677 R00678 R00679 R00681
R00682 R00683 R00684 R00685 R01376 R01657 R01814 R02722
R03664 R05317 R07213 R08160 R08547 R09570 R09583 R09638
R10180 R10661 R11119 R11328 R12031 R12032 R12055 R12151
R12413 R12417 R12436 R12542 R12758 R12782 R12784 R12957
Pathway
map00260  Glycine, serine and threonine metabolism
map00380  Tryptophan metabolism
map00400  Phenylalanine, tyrosine and tryptophan biosynthesis
map00404  Staurosporine biosynthesis
map00901  Indole alkaloid biosynthesis
map00966  Glucosinolate biosynthesis
map00970  Aminoacyl-tRNA biosynthesis
map00996  Biosynthesis of various alkaloids
map00997  Biosynthesis of various other secondary metabolites
map00999  Biosynthesis of various plant secondary metabolites
map01060  Biosynthesis of plant secondary metabolites
map01061  Biosynthesis of phenylpropanoids
map01063  Biosynthesis of alkaloids derived from shikimate pathway
map01070  Biosynthesis of plant hormones
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
map01240  Biosynthesis of cofactors
map04361  Axon regeneration
map04726  Serotonergic synapse
map04974  Protein digestion and absorption
map04978  Mineral absorption
map05143  African trypanosomiasis
map05230  Central carbon metabolism in cancer
Module
M00023  Tryptophan biosynthesis, chorismate => tryptophan
M00037  Melatonin biosynthesis, animals, tryptophan => serotonin => melatonin
M00038  Tryptophan metabolism, tryptophan => kynurenine => 2-aminomuconate
M00370  Glucosinolate biosynthesis, tryptophan => glucobrassicin
M00786  Fumitremorgin alkaloid biosynthesis, tryptophan + proline => fumitremorgin C/A
M00789  Rebeccamycin biosynthesis, tryptophan => rebeccamycin
M00790  Pyrrolnitrin biosynthesis, tryptophan => pyrrolnitrin
M00805  Staurosporine biosynthesis, tryptophan => staurosporine
M00808  Violacein biosynthesis, tryptophan => violacein
M00891  Ditryptophenaline biosynthesis, tryptophan + phenylalanine => ditryptophenaline
M00901  Fumiquinazoline biosynthesis, tryptophan + alanine + anthranilate => fumiquinazoline
M00912  NAD biosynthesis, tryptophan => quinolinate => NAD
M00936  Melatonin biosynthesis, plants, tryptophan => serotonin => melatonin
M00962  Psilocybin biosynthesis, tryptophan => psilocybin
M00963  Chanoclavine aldehyde biosynthesis, tryptophan => chanoclavine-I aldehyde
M00981  Geissoschizine biosynthesis, tryptophan => geissoschizine
Network
nt06028  Dopamine and serotonin metabolism
nt06036  Lysine degradation
Enzyme
1.3.3.10        1.4.1.19        1.4.3.2         1.4.3.-         
1.13.11.11      1.13.11.52      1.13.12.3       1.13.99.3       
1.14.14.156     1.14.16.4       1.14.19.9       1.14.19.58      
1.14.19.59      2.1.1.106       2.5.1.34        2.5.1.80        
2.6.1.27        2.6.1.28        2.6.1.99        2.6.1.-         
3.5.1.57        4.1.1.28        4.1.1.105       4.1.99.1        
4.1.99.25       4.2.1.20        4.2.1.122       4.3.1.31        
6.1.1.2         6.2.1.73        6.3.2.-
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Common amino acids
    C00078  Tryptophan (Trp)
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N06 PSYCHOANALEPTICS
   N06A ANTIDEPRESSANTS
    N06AX Other antidepressants
     N06AX02 Tryptophan
      D00020  Tryptophan (USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   L-Tryptophan
    D00020  Tryptophan (USP/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00020  L-Tryptophan
Other DBs
CAS: 73-22-3
PubChem: 3378
ChEBI: 16828
KNApSAcK: C00001396
PDB-CCD: TRP[PDBj]
NIKKAJI: J9.181B
LinkDB
KCF data

ATOM        15
            1   C8y C    17.0958  -16.0419
            2   C8y C    18.4268  -16.3221
            3   C8y C    16.3953  -17.2327
            4   C8x C    16.3953  -14.7810
            5   C1b C    19.4775  -15.4815
            6   N4x N    17.2359  -18.2835
            7   C8x C    14.9243  -17.2327
            8   C8x C    14.9943  -14.7810
            9   C1c C    20.7384  -16.1120
            10  C8x C    14.2238  -16.0419
            11  N1a N    20.7384  -17.5830
            12  C6a C    21.9292  -15.4815
            13  O6a O    23.1201  -16.1820
            14  O6a O    21.9292  -14.0805
            15  C8x C    18.4268  -17.7221
BOND        16
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     7  10 2
            10    9  11 1 #Up
            11    9  12 1
            12   12  13 1
            13   12  14 2
            14    8  10 1
            15    2  15 2
            16   15   6 1

» Japanese version

KEGG   COMPOUND: C00183
Entry
C00183                      Compound                               
Name
L-Valine;
2-Amino-3-methylbutyric acid
Formula
C5H11NO2
Exact mass
117.0790
Mol weight
117.15
Structure
Remark
Same as: D00039
Reaction
R01212 R01214 R01215 R01434 R01437 R02200 R03665 R04870
R08663 R10031 R10941 R10942
Pathway
map00280  Valine, leucine and isoleucine degradation
map00290  Valine, leucine and isoleucine biosynthesis
map00311  Penicillin and cephalosporin biosynthesis
map00460  Cyanoamino acid metabolism
map00770  Pantothenate and CoA biosynthesis
map00966  Glucosinolate biosynthesis
map00970  Aminoacyl-tRNA biosynthesis
map01060  Biosynthesis of plant secondary metabolites
map01063  Biosynthesis of alkaloids derived from shikimate pathway
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
map01240  Biosynthesis of cofactors
map02010  ABC transporters
map04974  Protein digestion and absorption
map04978  Mineral absorption
map05230  Central carbon metabolism in cancer
Module
M00019  Valine/isoleucine biosynthesis, pyruvate => valine / 2-oxobutanoate => isoleucine
M00119  Pantothenate biosynthesis, valine/L-aspartate => pantothenate
M00672  Penicillin biosynthesis, aminoadipate + cycteine + valine => penicillin
M00673  Cephamycin C biosynthesis, aminoadipate + cycteine + valine => cephamycin C
Network
nt06024  Valine, leucine and isoleucine degradation
Enzyme
1.4.1.8         1.4.1.9         1.4.1.23        1.14.14.38      
1.14.14.39      2.6.1.6         2.6.1.32        2.6.1.42        
2.6.1.66        4.1.1.14        6.1.1.9         6.3.2.26        
6.3.2.47
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Common amino acids
    C00183  Valine (Val)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   L-Valine
    D00039  Valine (USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00039  L-Valine
Other DBs
CAS: 72-18-4
PubChem: 3483
ChEBI: 16414
KNApSAcK: C00001398
PDB-CCD: VAL[PDBj]
NIKKAJI: J9.179K
LinkDB
KCF data

ATOM        8
            1   C1c C    24.8500  -19.0764
            2   C1c C    26.0666  -18.3804
            3   C6a C    23.6334  -18.3629
            4   N1a N    24.8442  -20.4802
            5   C1a C    27.2716  -19.0881
            6   C1a C    26.0725  -16.9825
            7   O6a O    22.4226  -19.0589
            8   O6a O    23.6392  -16.9707
BOND        7
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2

» Japanese version

KEGG   COMPOUND: C00082
Entry
C00082                      Compound                               
Name
L-Tyrosine;
(S)-3-(p-Hydroxyphenyl)alanine;
(S)-2-Amino-3-(p-hydroxyphenyl)propionic acid;
Tyrosine
Formula
C9H11NO3
Exact mass
181.0739
Mol weight
181.19
Structure
Remark
Same as: D00022
Reaction
R00031 R00728 R00729 R00730 R00731 R00732 R00733 R00734
R00735 R00736 R00737 R00739 R01795 R01815 R02078 R02918
R03539 R04730 R05671 R06626 R06751 R07211 R07212 R08825
R09254 R09521 R09830 R10059 R10246 R10671 R10964 R10968
R11366 R11917 R12150 R12161 R12235 R12540 R12541 R12611
R12759 R13031
Pathway
map00130  Ubiquinone and other terpenoid-quinone biosynthesis
map00261  Monobactam biosynthesis
map00350  Tyrosine metabolism
map00360  Phenylalanine metabolism
map00400  Phenylalanine, tyrosine and tryptophan biosynthesis
map00401  Novobiocin biosynthesis
map00460  Cyanoamino acid metabolism
map00680  Methane metabolism
map00730  Thiamine metabolism
map00940  Phenylpropanoid biosynthesis
map00950  Isoquinoline alkaloid biosynthesis
map00965  Betalain biosynthesis
map00966  Glucosinolate biosynthesis
map00970  Aminoacyl-tRNA biosynthesis
map00997  Biosynthesis of various other secondary metabolites
map00998  Biosynthesis of various antibiotics
map00999  Biosynthesis of various plant secondary metabolites
map01055  Biosynthesis of vancomycin group antibiotics
map01059  Biosynthesis of enediyne antibiotics
map01060  Biosynthesis of plant secondary metabolites
map01063  Biosynthesis of alkaloids derived from shikimate pathway
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
map01240  Biosynthesis of cofactors
map04728  Dopaminergic synapse
map04916  Melanogenesis
map04917  Prolactin signaling pathway
map04974  Protein digestion and absorption
map05012  Parkinson disease
map05030  Cocaine addiction
map05031  Amphetamine addiction
map05034  Alcoholism
map05230  Central carbon metabolism in cancer
Module
M00025  Tyrosine biosynthesis, chorismate => HPP => tyrosine
M00039  Monolignol biosynthesis, phenylalanine/tyrosine => monolignol
M00040  Tyrosine biosynthesis, chorismate => arogenate => tyrosine
M00042  Catecholamine biosynthesis, tyrosine => dopamine => noradrenaline => adrenaline
M00043  Thyroid hormone biosynthesis, tyrosine => triiodothyronine/thyroxine
M00044  Tyrosine degradation, tyrosine => homogentisate
M00127  Thiamine biosynthesis, prokaryotes, AIR (+ DXP/tyrosine) => TMP/TPP
M00369  Cyanogenic glycoside biosynthesis, tyrosine => dhurrin
M00827  C-1027 beta-amino acid moiety biosynthesis, tyrosine => 3-chloro-4,5-dihydroxy-beta-phenylalanyl-PCP
M00828  Maduropeptin beta-hydroxy acid moiety biosynthesis, tyrosine => 3-(4-hydroxyphenyl)-3-oxopropanoyl-PCP
M00889  Puromycin biosynthesis, ATP => puromycin
M00935  Methanofuran biosynthesis
M00961  Betacyanin biosynthesis, L-tyrosine => amaranthin
Network
nt06016  Phenylalanine and tyrosine metabolism
nt06028  Dopamine and serotonin metabolism
nt06322  TRH-TSH-TH signaling
nt06463  Parkinson disease
Enzyme
1.2.1.101       1.3.1.43        1.3.1.78        1.3.1.79        
1.4.1.20        1.4.3.2         1.10.3.1        1.11.1.8        
1.11.2.6        1.14.14.36      1.14.16.1       1.14.16.2       
1.14.18.1       1.14.-.-        1.21.1.1        2.1.1.304       
2.5.1.122       2.5.1.147       2.6.1.1         2.6.1.5         
2.6.1.9         2.6.1.57        2.6.1.58        2.6.1.103       
4.1.1.25        4.1.1.28        4.1.1.108       4.1.99.2        
4.1.99.19       4.1.99.24       4.3.1.23        4.3.1.25        
5.4.3.6         6.1.1.1         6.3.2.24        6.3.2.25
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Amino acids
   Common amino acids
    C00082  Tyrosine (Tyr)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00022  L-Tyrosine
Other DBs
CAS: 60-18-4
PubChem: 3382
ChEBI: 17895
KNApSAcK: C00001397
PDB-CCD: TYR[PDBj]
NIKKAJI: J9.173A
LinkDB
KCF data

ATOM        13
            1   C8y C    25.0600  -15.8200
            2   C8x C    25.0600  -17.2200
            3   C8x C    23.8700  -17.9200
            4   C8y C    22.6800  -17.2200
            5   C8x C    22.6800  -15.8200
            6   C8x C    23.8700  -15.1200
            7   C1b C    26.3200  -15.1200
            8   O1a O    21.4200  -17.9900
            9   C1c C    27.5100  -15.8200
            10  C6a C    28.7000  -15.1200
            11  O6a O    29.8900  -15.8200
            12  O6a O    28.7000  -13.7200
            13  N1a N    27.5100  -17.2200
BOND        13
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     4   8 1
            9     7   9 1
            10    9  10 1
            11   10  11 1
            12   10  12 2
            13    9  13 1 #Up

» Japanese version

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