EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H6ClO3 |
| Net Charge | -1 |
| Average Mass | 185.586 |
| Monoisotopic Mass | 185.00110 |
| SMILES | O=C([O-])Cc1ccc(O)c(Cl)c1 |
| InChI | InChI=1S/C8H7ClO3/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3,10H,4H2,(H,11,12)/p-1 |
| InChIKey | IYTUKSIOQKTZEG-UHFFFAOYSA-M |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3-chloro-4-hydroxyphenyl)acetate (CHEBI:747279) is a monocarboxylic acid anion (CHEBI:35757) |
| (3-chloro-4-hydroxyphenyl)acetate (CHEBI:747279) is conjugate base of (3-chloro-4-hydroxyphenyl)acetic acid (CHEBI:47106) |
| UniProt Name | Source |
|---|---|
| (3-chloro-4-hydroxyphenyl)acetate | UniProt |
| Manual Xrefs | Databases |
|---|---|
| CPD-10862 | MetaCyc |
| Citations |
|---|