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CHEBI:229975 - 3-hydroxy-3-(4-hydroxyphenyl)propanoate

ChEBI IDCHEBI:229975
ChEBI Name3-hydroxy-3-(4-hydroxyphenyl)propanoate
Stars
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC9H9O4
Net Charge-1
Average Mass181.167
Monoisotopic Mass181.05063
SMILESO=C([O-])CC(O)c1ccc(O)cc1
InChIInChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8,10-11H,5H2,(H,12,13)/p-1
InChIKeyAKWHTKRUNUYXDS-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-hydroxy-3-(4-hydroxyphenyl)propanoate (CHEBI:229975) is a monocarboxylic acid anion (CHEBI:35757)
3-hydroxy-3-(4-hydroxyphenyl)propanoate (CHEBI:229975) is conjugate base of Dihydroxyphenylpropionic acid (CHEBI:166658)
Incoming Relation(s)
Dihydroxyphenylpropionic acid (CHEBI:166658) is conjugate acid of 3-hydroxy-3-(4-hydroxyphenyl)propanoate (CHEBI:229975)
UniProt Name  Source
3-hydroxy-3-(4-hydroxyphenyl)propanoateUniProt