KEGG   COMPOUND: C00331
Entry
C00331                      Compound                               

Name
Indolepyruvate;
Indolepyruvic acid;
(Indol-3-yl)pyruvate;
Indole-3-pyruvate;
3-(Indol-3-yl)pyruvate
Formula
C11H9NO3
Exact mass
203.0582
Mol weight
203.1941
Structure
Reaction
Pathway
map00380  Tryptophan metabolism
map01100  Metabolic pathways
Enzyme
1.1.1.110       1.2.7.8         1.4.1.19        1.4.3.2         
1.14.13.168     2.1.1.47        2.6.1.27        2.6.1.28        
2.6.1.99        2.6.1.-         4.1.1.43        4.1.1.74
Other DBs
CAS: 392-12-1
PubChem: 3625
ChEBI: 29750
ChEMBL: CHEMBL485012
KNApSAcK: C00007571
PDB-CCD: 3IO[PDBj]
3DMET: B00089
NIKKAJI: J39.033J
LinkDB
KCF data

ATOM        15
            1   C8x C    15.8900  -16.5900
            2   C8x C    15.8900  -17.9900
            3   C8x C    17.1024  -18.6900
            4   C8y C    18.3149  -17.9900
            5   C8y C    18.3149  -16.5900
            6   C8x C    17.1024  -15.8900
            7   N4x N    19.6464  -18.4226
            8   C8x C    20.4693  -17.2900
            9   C8y C    19.6464  -16.1574
            10  C1b C    20.0775  -14.8306
            11  C5a C    21.4569  -14.5374
            12  O5a O    22.4195  -15.6069
            13  C6a C    21.8863  -13.2173
            14  O6a O    23.2757  -12.9222
            15  O6a O    20.9669  -12.1954
BOND        16
            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     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    9  10 1
            12   10  11 1
            13   11  12 2
            14   11  13 1
            15   13  14 1
            16   13  15 2

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