[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid (CHEBI:64899)

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ChEBI Name	[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid

ChEBI ID	CHEBI:64899

ChEBI ASCII Name	[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid

Definition	A 5-hydroxy monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by a 4-hydroxy-2,2,3-trimethylcyclopent-3-enyl group (the S-enantiomer).

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C10H16O3

Net Charge

Average Mass

184.23220

Monoisotopic Mass

184.10994

InChI

InChI=1S/C10H16O3/c1-6-8(11)4-7(5-9(12)13)10(6,2)3/h7,11H,4-5H2,1-3H3,(H,12,13)/t7-/m0/s1

InChIKey

URJCZGFYOSRITQ-ZETCQYMHSA-N

SMILES

CC1=C(O)C[C@@H](CC(O)=O)C1(C)C

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid (CHEBI:64899) has functional parent acetic acid (CHEBI:15366) [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid (CHEBI:64899) is a 5-hydroxy monocarboxylic acid (CHEBI:37125) [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid (CHEBI:64899) is a enol (CHEBI:33823) [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid (CHEBI:64899) is conjugate acid of [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate (CHEBI:64894)

Incoming	[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate (CHEBI:64894) is conjugate base of [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid (CHEBI:64899)

IUPAC Name

[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-en-1-yl]acetic acid

Citation	Type	Source
11278926	PubMed citation	Europe PMC

Last Modified

14 June 2012