| Entry |
|
|---|
| Name |
alpha-Isopropylmalate;
(2S)-2-Isopropylmalate;
(2S)-2-Hydroxy-2-isopropylsuccinic acid;
2-Isopropylmalic acid;
3-Carboxy-3-hydroxy-4-methylpentanoate;
3-Carboxy-3-hydroxyisocaproate;
(2S)-2-Isopropylmalic acid
|
|---|
| Formula |
C7H12O5
|
|---|
| Exact mass |
176.0685
|
|---|
| Mol weight |
176.17
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00290 | Valine, leucine and isoleucine biosynthesis |
| map01110 | Biosynthesis of secondary metabolites |
| map01210 | 2-Oxocarboxylic acid metabolism |
|
|---|
| Module |
| M00432 | Leucine biosynthesis, 2-oxoisovalerate => 2-oxoisocaproate |
|
|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA01 Fatty Acids and Conjugates
FA0117 Dicarboxylic acids
C02504 (2S)-2-Isopropylmalic acid
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 12
1 C1d C 26.5461 -19.2196
2 C1b C 27.7612 -18.5217
3 C1c C 25.3313 -18.5217
4 C6a C 26.5461 -20.6284
5 C6a C 29.1225 -19.2196
6 C1a C 24.1101 -19.2196
7 C1a C 25.3313 -17.1128
8 O6a O 25.3958 -21.3262
9 O6a O 27.7675 -21.3262
10 O6a O 30.3374 -18.5152
11 O1a O 27.5537 -19.9749
12 O6a O 29.0896 -20.6473
BOND 11
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 3 6 1
6 3 7 1
7 4 8 1
8 4 9 2
9 5 10 1
10 1 11 1 #Down
11 5 12 2
|
|---|
