CHEBI:215411 - Similin C

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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 Similin C
ChEBI ID CHEBI:215411
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H24O2
Net Charge 0
Average Mass 224.344
Monoisotopic Mass 224.17763
InChI InChI=1S/C14H24O2/c1-6-9(4)11-10(7-2)12(15)14(5,8-3)13(11)16/h9,13,16H,6-8H2,1-5H3/t9?,13-,14+/m1/s1
InChIKey IIWDJOXUWUASCX-CTWBKRIHSA-N
SMILES O=C1C(=C(C(CC)C)[C@H]([C@]1(CC)C)O)CC
Metabolite of Species Details
Cadophora (NCBI:txid210567) See: PubMed
ChEBI Ontology
Outgoing Similin C (CHEBI:215411) is a monoterpenoid (CHEBI:25409)
IUPAC Name
(4R,5R)-3-butan-2-yl-2,5-diethyl-4-hydroxy-5-methylcyclopent-2-en-1-one
Manual Xref Database
78442265 ChemSpider
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