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CHEBI:196150 - 12-Hydroxy-chiloscyphone

Default Structure
ChEBI IDCHEBI:196150
ChEBI Name12-Hydroxy-chiloscyphone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O2
Net Charge0
Average Mass234.339
Monoisotopic Mass234.16198
SMILESC=C(CO)C(=O)[C@H]1CCC2=CCC[C@H](C)[C@]21C
InChIInChI=1S/C15H22O2/c1-10(9-16)14(17)13-8-7-12-6-4-5-11(2)15(12,13)3/h6,11,13,16H,1,4-5,7-9H2,2-3H3/t11-,13+,15+/m0/s1
InChIKeyNEUJHRQRRDXWQD-NJZAAPMLSA-N
ChEBI Ontology
Outgoing Relation(s)
12-Hydroxy-chiloscyphone (CHEBI:196150) is a iridoid monoterpenoid (CHEBI:50563)
IUPAC Name 
1-[(1S,7S,7aS)-7,7a-dimethyl-1,2,3,5,6,7-hexahydroinden-1-yl]-2-(hydroxymethyl)prop-2-en-1-one
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