CHEBI:218865 - Cis-2-Hydroxymethyl-3-methylcyclopentano

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Cis-2-Hydroxymethyl-3-methylcyclopentano
ChEBI ID CHEBI:218865
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C7H12O2
Net Charge 0
Average Mass 128.171
Monoisotopic Mass 128.08373
InChI InChI=1S/C7H12O2/c1-5-2-3-7(9)6(5)4-8/h5-6,8H,2-4H2,1H3/t5-,6-/m1/s1
InChIKey QGYTVSTZPARCLA-PHDIDXHHSA-N
SMILES O=C1[C@@H]([C@H](C)CC1)CO
ChEBI Ontology
Outgoing Cis-2-Hydroxymethyl-3-methylcyclopentano (CHEBI:218865) is a cyclic ketone (CHEBI:3992)
IUPAC Name
(2S,3R)-2-(hydroxymethyl)-3-methylcyclopentan-1-one
Manual Xref Database
61616414 ChemSpider
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