13-hydroxy-tricho-2(12),9(10)-diene-3-one (CHEBI:200357)

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CHEBI:200357 - 13-hydroxy-tricho-2(12),9(10)-diene-3-one

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ChEBI ID	CHEBI:200357
ChEBI Name	13-hydroxy-tricho-2(12),9(10)-diene-3-one
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C15H22O2
Net Charge	0
Average Mass	234.339
Monoisotopic Mass	234.16198
SMILES	CC1=CC[C@@](C)([C@@]2(C)CC(=O)C=C2CO)CC1
InChI	InChI=1S/C15H22O2/c1-11-4-6-14(2,7-5-11)15(3)9-13(17)8-12(15)10-16/h4,8,16H,5-7,9-10H2,1-3H3/t14-,15+/m1/s1
InChIKey	FBSYQYBRVWGYEB-CABCVRRESA-N

Species of Metabolite	Component	Source	Comments
Fusariumspecies (ncbitaxon:29916)	-	DOI (10.1016/s0040-4039(00)79127-1)

ChEBI Ontology

Outgoing Relation(s)
	13-hydroxy-tricho-2(12),9(10)-diene-3-one (CHEBI:200357) is a cyclic ketone (CHEBI:3992)

IUPAC Name
(4R)-4-[(1S)-1,4-dimethylcyclohex-3-en-1-yl]-3-(hydroxymethyl)-4-methylcyclopent-2-en-1-one

Manual Xrefs	Databases
78436149	ChemSpider