| Entry |
|
|---|
| Name |
(2S,3R)-3-Hydroxybutane-1,2,3-tricarboxylate;
Methylisocitrate;
Methylisocitric acid
|
|---|
| Formula |
C7H10O7
|
|---|
| Exact mass |
206.0427
|
|---|
| Mol weight |
206.15
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01120 | Microbial metabolism in diverse environments |
|
|---|
| Module |
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|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
FA Fatty acyls
FA01 Fatty Acids and Conjugates
FA0105 Hydroxy fatty acids
C04593 Methylisocitric acid
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 14
1 C1c C 17.5000 -17.5716
2 C1d C 16.0655 -16.9282
3 C1b C 18.7093 -16.8767
4 C6a C 17.5000 -19.1838
5 C6a C 16.0655 -15.6725
6 C1a C 14.7798 -17.4894
7 O1a O 16.0784 -18.2983
8 C6a C 19.9250 -17.5716
9 O6a O 16.3543 -19.8085
10 O6a O 18.7157 -19.8785
11 O6a O 17.3713 -14.9777
12 O6a O 14.8498 -14.9777
13 O6a O 19.9508 -18.8950
14 O6a O 21.1344 -16.8704
BOND 13
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Down
6 2 7 1 #Up
7 3 8 1
8 4 9 1
9 4 10 2
10 5 11 1
11 5 12 2
12 8 13 1
13 8 14 2
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