- 3,4-dihydroxyphenylacetyl-CoA(4-)
- Charge: -4
- Formula: C29H38N7O19P3S
- Compartment: c - cytosol
- Universal Metabolite: 34dphacoa
CHEBI:189558
- 3,4-dihydroxyphenylacetyl-CoA(4-)
- Type: Small Molecule
- InChiKey: BWFUCVJSCADRJW-CECATXLMSA-J
- View on ChEBI
Properties
- Molecular Mass||g/mol: 913.64[0], 917.0[1]
- SMILES: CC(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-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)Cc1ccc(O)c(O)c1[0,1]
- Names: 3,4-dihydroxyphenylacetyl-CoA[0,1]
Linkouts
- CHEBI: 189558 [0]
- SEED Compound: cpd22085 [1]
- MetaCyc Compound: 34-DIHYDROXYPHENYLACETYL-COA [1]
- MetaNetX Chemical: MNXM14479 [1]
MEMOTE Flags
This metabolite was flagged in the following MEMOTE tests:
A total of 63 (3.25%) metabolites are not produced by any reaction of the model: cysi__L_c, __Ecoli_panGEMs__dsbard_p, gmplys_c, 2pglyc_c, dmbzid_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 34dphacoa_c in 562_74553_json
| BiGG ID | Name | Reference | Transport | Collection-specific | Model | |
|---|---|---|---|---|---|---|
| BiGG ID | Name | Reference | Transport | Collection-specific | Model |