KEGG   COMPOUND: C03063Help
Entry
C03063                      Compound                               

Name
2-Oxohept-3-enedioate;
2-Oxohept-3-ene-1,7-dioate
Formula
C7H8O5
Exact mass
172.0372
Mol weight
172.1354
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00350  Tyrosine metabolism
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Module
M00533  Homoprotocatechuate degradation, homoprotocatechuate => 2-oxohept-3-enedioate
Enzyme
4.1.1.68        4.2.1.-         5.3.3.-
Other DBs
PubChem: 5963
ChEBI: 1254 17205
3DMET: B00533
NIKKAJI: J2.368.403I
KCF data Show

ATOM        12
            1   C2b C    26.3244  -21.7910
            2   C2b C    25.1078  -21.0891
            3   C5a C    26.3303  -23.1891
            4   C1b C    23.8970  -21.7970
            5   C6a C    27.5469  -23.8851
            6   O5a O    25.1195  -23.8910
            7   C1b C    22.6802  -21.1008
            8   O6a O    27.5528  -25.2832
            9   O6a O    28.7577  -23.1832
            10  C6a C    21.4696  -21.8027
            11  O6a O    20.2587  -21.1067
            12  O6a O    21.4753  -23.2008
BOND        11
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 2
            6     4   7 1
            7     5   8 1
            8     5   9 2
            9     7  10 1
            10   10  11 1
            11   10  12 2

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