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CHEBI:64894 - [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate

ChEBI IDCHEBI:64894
ChEBI Name[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate
Stars
ASCII Name[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate
DefinitionA hydroxy monocarboxylic acid anion that is the conjugate base of [(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetic acid, arising from deprotonation of the carboxy group; major species at pH 7.3.
Last Modified14 June 2012
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC10H15O3
Net Charge-1
Average Mass183.227
Monoisotopic Mass183.10267
SMILESCC1=C(O)C[C@@H](CC(=O)[O-])C1(C)C
InChIInChI=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)/p-1/t7-/m0/s1
InChIKeyURJCZGFYOSRITQ-ZETCQYMHSA-M
ChEBI Ontology
Outgoing Relation(s)
[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate (CHEBI:64894) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
[(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)
Incoming Relation(s)
[(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)
IUPAC Name 
[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-en-1-yl]acetate
UniProt Name  Source
[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetateUniProt
Manual XrefsDatabases
CPD-14305MetaCyc
Citations