- (E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
- Charge: -1
- Formula: C9H9O4
- Compartment: c - cytosol
- Universal Metabolite: cenchddd
CHEBI:61451
- (E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
- Type: Small Molecule
- InChiKey: AEUBLTTWYCDTGM-HXOXMVQHSA-M
- View on ChEBI
Properties
- Molecular Mass||g/mol: 181.1654[0], 181.0[1]
- SMILES: O=C([O-])/C=C/C1=CC=C[C@H](O)[C@@H]1O[0], O=C([O-])/C=C/C1=CC=C[C@@H](O)[C@H]1O[1]
- Names: (E)-3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate[0], (2E)-3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate[0], (E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate anion[0], (E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate(1-)[0], (2E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate[0], (2E)-3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)acrylate[0], cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol[1], (2E)-3-(5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate[1], (2E)-3-(cis-5,6-Dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate[1], (2E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dien-1-yl]prop-2-enoate[1], 3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate[1], cis-3-(3-carboxyethenyl)-3,5-cyclohexadiene-1,2-diol[1]
MEMOTE Flags
This metabolite was flagged in the following MEMOTE tests:
A total of 81 (4.23%) metabolites are not produced by any reaction of the model: __iECx55__mococdp_c, __iECx55__apoACP_c, agdpcbi_c, ag_c, __iECx55__trnaala_c, ...
Orphans are metabolites that are only consumed but not produced by reactions in the model. They may indicate the presence of network and knowledge gaps. Implementation: Find orphan metabolites structurally by considering only reaction equations and bounds. FBA is not carried out.
Reactions involving cenchddd_c in iS_1188
| BiGG ID | Name | Reference | Transport | Collection-specific | Model | |
|---|---|---|---|---|---|---|
| BiGG ID | Name | Reference | Transport | Collection-specific | Model |