Universal:mmcoa__S
(S)-methylmalonyl-CoA(5-)
Default Component
mmcoa__S:-5
- (S)-methylmalonyl-CoA(5-)
- Charge: -5
- Formula: C25H35N7O19P3S
CHEBI:57327
- (S)-methylmalonyl-CoA(5-)
- Type: Small Molecule
- InChiKey: MZFOKIKEPGUZEN-IBNUZSNCSA-I
- View on ChEBI
Properties
- Molecular Mass||g/mol: 862.567[0], 863.0[1]
- SMILES: C[C@@H](C(=O)[O-])C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-][0,1]
- Names: (S)-methylmalonyl-CoA[0,1], D-methylmalonyl-CoA[1], (2S)-Methylmalonyl-CoA[1], (2S)-methyl-malonyl-CoA[1], (S)-2-Methyl-3-oxopropionyl-CoA[1], (S)-3-Oxo-2-methylpropanoyl-CoA[1], (S)-Methylmalonyl-CoA[1], (S)-Methylmalonyl-coenzyme A[1], CH3-malonyl-CoA[1], D-Methylmalonyl-CoA[1], methyl-malonyl-coenzyme A[1]
Linkouts
- CHEBI: 57327 [0]
- SEED Compound: cpd00519 [1]
- KEGG Compound: C00683 [1]
- MetaCyc Compound: D-METHYL-MALONYL-COA [1]
- MetaNetX Chemical: MNXM89955 [1]
Alternative Component
mmcoa__S:0
- (S)-methylmalonyl-CoA
- Charge: 0
- Formula: C25H40N7O19P3S
CHEBI:15466
- (S)-methylmalonyl-CoA
- Type: Small Molecule
- InChiKey: MZFOKIKEPGUZEN-IBNUZSNCSA-N
- View on ChEBI
Properties
- Molecular Mass||g/mol: 867.60816[0]
- SMILES: C[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O[0]
- Names: (S)-2-Methyl-3-oxopropanoyl-CoA[0], (S)-2-Methyl-3-oxopropionyl-CoA[0], (S)-Methylmalonyl-CoA[0], (S)-Methylmalonyl-coenzyme A[0], (S)-3-oxo-2-methylpropanoyl-CoA[0], 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(2S)-2-methyl-3-oxopropanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}[0]
Metabolite in Models
| BiGG ID | Compartment | Charge | Model | Organism | |
|---|---|---|---|---|---|
| BiGG ID | Compartment | Charge | Model | Organism |