OntologiesslmclassesCHEBI:76204   
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(2S)-2-(4-{[(1R,2S)-2-hydroxycyclopentyl]methyl}phenyl)propanoic acidImported
http://purl.obolibrary.org/obo/CHEBI_76204

A monocarboxylic acid that is propionic acid in which one of the hydrogens at position 2 is substituted by a 4-[(2-hydroxycyclopentyl)methyl]phenyl group (the 2S,1'R,2'S-stereoisomer. The active metabolite of loxoprofen.

Defined bychebi
Exact Synonyms
(2S)-2-(4-{[(1R,2S)-2-hydroxycyclopentyl]methyl}phenyl)propanoic acid
Related Synonyms
loxoprofen active metabolite
loxoprofen-SRS
class Information
charge

0

formula

C15H20O3

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C15H20O3/c1-10(15(17)18)12-7-5-11(6-8-12)9-13-3-2-4-14(13)16/h5-8,10,13-14,16H,2-4,9H2,1H3,(H,17,18)/t10-,13+,14-/m0/s1

inchikey

SHAHPWSYJFYMRX-GDLCADMTSA-N

in_subset

3_STAR

mass

248.31750

monoisotopicmass

248.14124

smiles

C[C@H](C(O)=O)c1ccc(C[C@H]2CCC[C@@H]2O)cc1

class Relations