EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C9H10O4 |
| Net Charge | 0 |
| Average Mass | 182.175 |
| Monoisotopic Mass | 182.05791 |
| SMILES | O=C(O)C(=O)CC1=CC[C@@H](O)C=C1 |
| InChI | InChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-3,7,10H,4-5H2,(H,12,13)/t7-/m0/s1 |
| InChIKey | HDHFXEPVMQZSFA-ZETCQYMHSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (4R)-3,4-dihydro-4-hydroxyphenylpyruvic acid (CHEBI:85344) is a 3,4-dihydro-4-hydroxyphenylpyruvic acid (CHEBI:64939) |
| (4R)-3,4-dihydro-4-hydroxyphenylpyruvic acid (CHEBI:85344) is conjugate acid of (4R)-3,4-dihydro-4-hydroxyphenylpyruvate (CHEBI:84354) |
| Incoming Relation(s) |
| (4R)-3,4-dihydro-4-hydroxyphenylpyruvate (CHEBI:84354) is conjugate base of (4R)-3,4-dihydro-4-hydroxyphenylpyruvic acid (CHEBI:85344) |
| IUPAC Name |
|---|
| 3-[(4R)-4-hydroxycyclohexa-1,5-dien-1-yl]-2-oxopropanoic acid |
| Manual Xrefs | Databases |
|---|---|
| CPD-17510 | MetaCyc |
| Citations |
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