- 3-dehydroquinate
- Charge: -1
- Formula: C7H9O6
- Compartment: c - cytosol
- Universal Metabolite: 3dhq
CHEBI:32364
- 3-dehydroquinate
- Type: Small Molecule
- InChiKey: WVMWZWGZRAXUBK-SYTVJDICSA-M
- View on ChEBI
Properties
- Molecular Mass||g/mol: 189.14276[0], 189.0[1]
- SMILES: O=C1C[C@@](O)(C(=O)[O-])C[C@@H](O)[C@@H]1O[0,1]
- Names: 3-dehydroquinate[0,1], rel-(1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexanecarboxylate[0,1], 5-Dehydroquinate[0,1], 3-Dehydroquinate[0,1], 3-Dehydroquinic acid[1], 3-dehydroquinic acid[1], 5-Dehydroquinic acid[1], 5-de-H-quinate[1], 5-dehydroquinate[1], 5-dehydroquinic acid[1]
Linkouts
- CHEBI: 32364 [0]
- KEGG Compound: C00944 [0,1]
- MetaCyc Compound: DEHYDROQUINATE [0,1]
- SEED Compound: cpd00699 [1]
- MetaNetX Chemical: MNXM478 [1]
MEMOTE Flags
This metabolite was flagged in the following MEMOTE tests:
This model contains 626 unconserved metabolites: for_e, pydx_c, mnl1p_c, hisp_c, pydx5p_c, ...
The list of unconserved metabolites is computed using the algorithm described in section 3.2 of "Detection of Stoichiometric Inconsistencies in Biomolecular Models." Bioinformatics 24, no. 19 (2008): 2245. doi: 10.1093/bioinformatics/btn425.
Reactions involving 3dhq_c in iYS854
| BiGG ID | Name | Reference | Transport | Collection-specific | Model | |
|---|---|---|---|---|---|---|
| BiGG ID | Name | Reference | Transport | Collection-specific | Model |