Universal:homoval
homovanillate
Default Component
homoval:-1
- homovanillate
- Charge: -1
- Formula: C9H9O4
CHEBI:133744
- homovanillate
- Type: Small Molecule
- InChiKey: QRMZSPFSDQBLIX-UHFFFAOYSA-M
- View on ChEBI
Properties
- Molecular Mass||g/mol: 181.166[0], 181.0[1]
- SMILES: COc1cc(CC(=O)[O-])ccc1O[0,1]
- Names: 3-methoxy-4-hydroxyphenylacetate[0,1], (4-hydroxy-3-methoxyphenyl)acetate[0], Homovanillate[1], 3-Methoxy-4-hydroxyphenylacetate[1], 3-methoxy-4-hydroxyphenylacetic acid[1], 4-hydroxy-3-methoxybenzenacetic acid[1], 4-hydroxy-3-methoxyphenylacetic acid[1], Homovanillic acid[1], homovanillate[1], homovanillic acid[1], vanillacetic acid[1]
Linkouts
- CHEBI: CHEBI:133744 [0]
- SEED Compound: cpd03312 [1]
- KEGG Compound: C05582 [1]
- MetaCyc Compound: CPD-7651 [1]
- MetaNetX Chemical: MNXM3287 [1]
Alternative Component
homoval:0
- homovanillic acid
- Charge: 0
- Formula: C9H10O4
CHEBI:545959
- homovanillic acid
- Type: Small Molecule
- InChiKey: QRMZSPFSDQBLIX-UHFFFAOYSA-N
- View on ChEBI
Properties
- Molecular Mass||g/mol: 182.1733[0]
- SMILES: COc1cc(CC(=O)O)ccc1O[0]
- Names: Homovanillic acid[0], 2-(4-hydroxy-3-methoxyphenyl)acetic acid[0], (4-hydroxy-3-methoxyphenyl)acetic acid[0], Vanillacetic acid[0], 4-Hydroxy-3-methoxybenzeneacetic acid[0], 3-Methoxy-4-hydroxyphenylacetic acid[0], HVA[0], 3-Methoxy-4-hydroxyphenylacetate[0]
Linkouts
- CHEBI: CHEBI:545959 [0]
- KEGG Compound: C05582 [0]
- MetaCyc Compound: CPD-7651 [0]
- Wikipedia: Homovanillic_acid [0]
- HMDB: HMDB0000118 [0]
Metabolite in Models
| BiGG ID | Compartment | Charge | Model | Organism | |
|---|---|---|---|---|---|
| BiGG ID | Compartment | Charge | Model | Organism |