KEGG   COMPOUND: C04052
Entry
C04052                      Compound                               
Name
5-Carboxy-2-oxohept-3-enedioate;
5-Oxopent-3-ene-1,2,5-tricarboxylate
Formula
C8H8O7
Exact mass
216.027
Mol weight
216.1449
Structure
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        5.3.3.10
Other DBs
PubChem: 6753
ChEBI: 15924
3DMET: B04923
NIKKAJI: J2.378.574I
KCF data

ATOM        15
            1   C1c C    24.5043  -21.7488
            2   C2b C    25.7156  -21.0466
            3   C1b C    23.2872  -21.0525
            4   C6a C    24.5043  -23.1472
            5   C2b C    26.9326  -21.7430
            6   C6a C    22.0761  -21.7547
            7   O6a O    23.2931  -23.8493
            8   O6a O    25.7156  -23.8493
            9   C5a C    26.9386  -23.1414
            10  O6a O    20.8648  -21.0583
            11  O6a O    22.0818  -23.1531
            12  C6a C    26.9268  -24.5398
            13  O5a O    28.1556  -23.8376
            14  O6a O    28.1381  -25.2479
            15  O6a O    25.7097  -25.2303
BOND        14
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     6  10 1
            10    6  11 2
            11    9  12 1
            12    9  13 2
            13   12  14 1
            14   12  15 2

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