Mitibetaimolone (CHEBI:205272)

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CHEBI:205272 - Mitibetaimolone

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ChEBI ID	CHEBI:205272
ChEBI Name	Mitibetaimolone
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C15H24O4
Net Charge	0
Average Mass	268.353
Monoisotopic Mass	268.16746
SMILES	CC(C)=C[C@@H]1C(=O)[C@H](C)C[C@H](O)[C@@H]2O[C@H](O)C[C@]12C
InChI	InChI=1S/C15H24O4/c1-8(2)5-10-13(18)9(3)6-11(16)14-15(10,4)7-12(17)19-14/h5,9-12,14,16-17H,6-7H2,1-4H3/t9-,10-,11+,12+,14+,15-/m1/s1
InChIKey	IYJNAERMIXQHEJ-BBEFNTSISA-N

Species of Metabolite	Component	Source	Comments
Lactarius mitissimus (ncbitaxon:118866)	-	DOI (10.1002/hlca.200900227)

ChEBI Ontology

Outgoing Relation(s)
	Mitibetaimolone (CHEBI:205272) is a oxolanes (CHEBI:26912)

IUPAC Name
(2S,3aR,4S,6R,8S,8aR)-2,8-dihydroxy-3a,6-dimethyl-4-(2-methylprop-1-enyl)-3,4,6,7,8,8a-hexahydro-2H-cyclohepta[b]uran-5-one

Manual Xrefs	Databases
28286894	ChemSpider