KEGG   COMPOUND: C01036Help
Entry
C01036                      Compound                               

Name
4-Maleylacetoacetate;
4-Maleylacetoacetic acid
Formula
C8H8O6
Exact mass
200.0321
Mol weight
200.1455
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00350  Tyrosine metabolism
map00643  Styrene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
Module
M00044  Tyrosine degradation, tyrosine => homogentisate
Enzyme
1.13.11.5       5.2.1.2
Other DBs
CAS: 5698-52-2
PubChem: 4279
ChEBI: 17105 47904
ChEMBL: CHEMBL1743220
KNApSAcK: C00007508
3DMET: B00226
NIKKAJI: J906.081B
LinkDB All DBs
KCF data Show

ATOM        14
            1   C5a C    23.8966  -21.7895
            2   C1b C    25.1073  -22.4913
            3   C1b C    23.8966  -20.3917
            4   O5a O    22.6859  -22.4913
            5   C5a C    25.1073  -23.8893
            6   C6a C    25.1073  -19.6898
            7   C2b C    23.8966  -24.5911
            8   O5a O    26.3239  -24.5911
            9   O6a O    26.3239  -20.3917
            10  O6a O    25.1073  -18.2920
            11  C2b C    23.8966  -25.9889
            12  C6a C    25.1073  -26.6908
            13  O6a O    26.3239  -25.9889
            14  O6a O    25.1073  -28.0886
BOND        13
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     3   6 1
            6     5   7 1
            7     5   8 2
            8     6   9 1
            9     6  10 2
            10    7  11 2
            11   11  12 1
            12   12  13 1
            13   12  14 2

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