| Entry |
|
|---|
| 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 |
188.13
|
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| Structure |
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|---|
| Reaction |
|
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| Pathway |
| map01110 | Biosynthesis of secondary metabolites |
| map01120 | Microbial metabolism in diverse environments |
| map01210 | 2-Oxocarboxylic acid metabolism |
|
|---|
| 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 |
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| Enzyme |
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| 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
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| Other DBs |
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| 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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