- trans-caffeate
- Charge: -1
- Formula: C9H7O4
- Compartment: c - cytosol
- Universal Metabolite: 34dhcinm
CHEBI:57770
- trans-caffeate
- Type: Small Molecule
- InChiKey: QAIPRVGONGVQAS-DUXPYHPUSA-M
- View on ChEBI
Properties
- Molecular Mass||g/mol: 179.1495[0], 179.0[1,2], 10000000.0[3], 180.0[4]
- SMILES: O=C([O-])/C=C/c1ccc(O)c(O)c1[0,1,4], O=C([O-])/C=C/c1cccc(O)c1O[2]
- Names: (E)-caffeate[0], trans-caffeate anion[0], trans-caffeate(1-)[0], (2E)-3-(3,4-dihydroxyphenyl)acrylate[0], 3,4-dihydroxy-trans-cinnamate[0,1,4], (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate[0], Caffeate[1,4], (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid[1,4], 3,4-Dihydroxy-trans-cinnamate[1,4], 3,4-Dihydroxycinnamic acid[1,4], Caffeic acid[1,4], cis-Caffeic acid[1,4], trans-Caffeate[1,4], trans-caffeate[1,4], trans-caffeic acid[1,4], 2,3-dihydroxicinnamic acid[2,3], (2E)-3-(2,3-Dihydroxyphenyl)prop-2-enoate[2], (2E)-3-(2,3-dihydroxyphenyl)prop-2-enoate[2], 2,3-dihydroxy-trans-cinnamate[2], 2,3-dihydroxycinnamic acid[2], trans-2,3-Dihydroxycinnamate[2]
MEMOTE Flags
This metabolite was flagged in the following MEMOTE tests:
A total of 116 (6.05%) metabolites are not consumed by any reaction of the model: __iSF_1195__23dappa_c, hqn_c, aconm_c, __iSF_1195__alatrna_c, __iSF_1195__lpp_p, ...
Dead-ends are metabolites that can only be produced but not consumed by reactions in the model. They may indicate the presence of network and knowledge gaps. Implementation: Find dead-end metabolites structurally by considering only reaction equations and bounds. FBA is not carried out.
Reactions involving 34dhcinm_c in iSF_1195
| BiGG ID | Name | Reference | Transport | Collection-specific | Model | |
|---|---|---|---|---|---|---|
| BiGG ID | Name | Reference | Transport | Collection-specific | Model |