KEGG   COMPOUND: C04002
Entry
C04002                      Compound                               
Name
(Z)-But-1-ene-1,2,4-tricarboxylate;
Homo-cis-aconitate;
cis-Homoaconitate;
(Z)-1,2,4-But-1-enetricarboxylic acid;
(1Z)-But-1-ene-1,2,4-tricarboxylic acid
Formula
C7H8O6
Exact mass
188.0321
Mol weight
188.1348
Structure
Reaction
Pathway
map00300  Lysine biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01120  Microbial metabolism in diverse environments
map01210  2-Oxocarboxylic acid metabolism
map01230  Biosynthesis of amino acids
Module
M00030  Lysine biosynthesis, AAA pathway, 2-oxoglutarate => 2-aminoadipate => lysine
M00433  Lysine biosynthesis, 2-oxoglutarate => 2-oxoadipate
M00608  2-Oxocarboxylic acid chain extension, 2-oxoglutarate => 2-oxoadipate => 2-oxopimelate => 2-oxosuberate
Enzyme
4.2.1.36        4.2.1.114       4.2.1.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0117 Dicarboxylic acids
    C04002  (1Z)-But-1-ene-1,2,4-tricarboxylic acid
Other DBs
PubChem: 6715
ChEBI: 17516
LIPIDMAPS: LMFA01030999
3DMET: B00663
NIKKAJI: J181.759K
KCF data

ATOM        13
            1   C2c C    25.8300  -20.5800
            2   C1b C    27.0900  -19.8800
            3   C2b C    24.6400  -19.8800
            4   C6a C    25.8300  -21.9800
            5   C1b C    28.2800  -20.5800
            6   C6a C    23.4500  -20.5800
            7   O6a O    27.0900  -22.6800
            8   O6a O    24.6400  -22.6800
            9   C6a C    29.4700  -19.8800
            10  O6a O    23.4500  -21.9100
            11  O6a O    22.1900  -19.8800
            12  O6a O    29.4700  -18.4800
            13  O6a O    30.7300  -20.5800
BOND        12
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     6  10 2
            10    6  11 1
            11    9  12 2
            12    9  13 1

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