KEGG   COMPOUND: C00072Help
Entry
C00072                      Compound                               

Name
Ascorbate;
Ascorbic acid;
L-Ascorbate;
L-Ascorbic acid;
Vitamin C
Formula
C6H8O6
Exact mass
176.0321
Mol weight
176.1241
Structure
Mol fileKCF fileDB search
Remark
Same as: D00018
Reaction
Pathway
map00053  Ascorbate and aldarate metabolism
map00480  Glutathione metabolism
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01120  Microbial metabolism in diverse environments
map02060  Phosphotransferase system (PTS)
map04066  HIF-1 signaling pathway
map04977  Vitamin digestion and absorption
Module
M00114  Ascorbate biosynthesis, plants, glucose-6P => ascorbate
M00129  Ascorbate biosynthesis, animals, glucose-1P => ascorbate
M00550  Ascorbate degradation, ascorbate => D-xylulose-5P
Enzyme
1.1.3.8         1.3.2.3         1.3.3.12        1.6.5.4         
1.8.5.1         1.10.2.1        1.10.3.3        1.11.1.11       
1.14.17.1       1.14.17.3       1.14.17.4       1.14.-.-        
1.16.5.1        1.23.5.1        2.7.1.194
Brite
Compounds with biological roles [BR:br08001]
 Vitamins and Cofactors
  Vitamins
   Water-soluble vitamins
    C00072  Ascorbic acid (Vitamin C)
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A11 VITAMINS
   A11G ASCORBIC ACID (VITAMIN C), INCL. COMBINATIONS
    A11GA Ascorbic acid (vitamin C), plain
     A11GA01 Ascorbic acid (vit C)
      D00018  Ascorbic acid (JP17/USP/INN) <JP/US>
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G01 GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
   G01A ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
    G01AD Organic acids
     G01AD03 Ascorbic acid
      D00018  Ascorbic acid (JP17/USP/INN) <JP/US>
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01X OTHER OPHTHALMOLOGICALS
    S01XA Other ophthalmologicals
     S01XA15 Ascorbic acid
      D00018  Ascorbic acid (JP17/USP/INN) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  31  Vitamins
   314  Vitamin C preparations
    3140  Vitamin C preparations
     D00018  Ascorbic acid (JP17/USP/INN)
Classification of Japanese OTC drugs [BR:br08313]
 Nourishing tonics and health supplements
  38 Vitamin C based drugs
   D00018  Ascorbic acid (JP17/USP/INN)
  41 Vitamin EC based drugs
   D00018  Ascorbic acid (JP17/USP/INN)
  43 Vitamin containing supplements
   D00018  Ascorbic acid (JP17/USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Ascorbic acid
    D00018  Ascorbic acid (JP17/USP/INN)
Pharmaceutical additives in Japan [BR:br08316]
 Stabilizing agent
  D00018  [001008] Ascorbic acid
 Buffering agent
  D00018  [001008] Ascorbic acid
 Flavoring substance
  D00018  [001008] Ascorbic acid
 Antioxidant agent
  D00018  [001008] Ascorbic acid
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00018  Ascorbic acid
  D00018  Ascorbic acid powder
  D00018  Ascorbic acid injection
Animal drugs in Japan [BR:br08331]
 96  Agents affecting metabolism
  962  Vitamin preparations
   9624  Vitamin C and preparations
    C00072  Ascorbate
Major components of natural products [BR:br08323]
 Medicinal herbs
  Cranberry
   C00072  Ascorbate
  Rose hip
   C00072  Ascorbate
BRITE hierarchy
Other DBs
CAS: 50-81-7
PubChem: 3372
ChEBI: 29073 38290
ChEMBL: CHEMBL196
KNApSAcK: C00001179
PDB-CCD: ASC[PDBj]
3DMET: B01147
NIKKAJI: J2.301I
LinkDB All DBs
KCF data Show

ATOM        12
            1   C1y C    28.9431  -22.0676
            2   C2y C    29.3912  -23.3888
            3   O7x O    30.0780  -21.2526
            4   C2y C    30.7940  -23.3888
            5   C7x C    31.2131  -22.0850
            6   O1a O    31.6263  -24.5181
            7   O6a O    32.1968  -21.0897
            8   C1c C    27.7354  -21.3704
            9   C1b C    26.5276  -22.0676
            10  O1a O    28.5753  -24.5274
            11  O1a O    27.7351  -19.9591
            12  O1a O    25.2940  -21.3555
BOND        12
            1     1   2 1
            2     1   3 1
            3     2   4 2
            4     3   5 1
            5     4   6 1
            6     5   7 2
            7     4   5 1
            8     1   8 1
            9     8   9 1
            10    2  10 1
            11    8  11 1 #Down
            12    9  12 1

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