(1RS,6SR,10SR)-6,10-dimethylbicyclo[4.4.0]decan-3-one (CHEBI:200698)

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CHEBI:200698 - (1RS,6SR,10SR)-6,10-dimethylbicyclo[4.4.0]decan-3-one

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ChEBI ID	CHEBI:200698
ChEBI Name	(1RS,6SR,10SR)-6,10-dimethylbicyclo[4.4.0]decan-3-one
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C12H20O
Net Charge	0
Average Mass	180.291
Monoisotopic Mass	180.15142
SMILES	C[C@@H]1CCC[C@]2(C)CCC(=O)C[C@@H]12
InChI	InChI=1S/C12H20O/c1-9-4-3-6-12(2)7-5-10(13)8-11(9)12/h9,11H,3-8H2,1-2H3/t9-,11+,12-/m1/s1
InChIKey	XMPCQTDMPUUQFZ-ADEWGFFLSA-N

Species of Metabolite	Component	Source	Comments
Chondromyces crocatus (ncbitaxon:52)	-	DOI (10.1016/j.tet.2004.03.005)

ChEBI Ontology

Outgoing Relation(s)
	(1RS,6SR,10SR)-6,10-dimethylbicyclo[4.4.0]decan-3-one (CHEBI:200698) is a cyclic ketone (CHEBI:3992)

IUPAC Name
(4aR,8R,8aS)-4a,8-dimethyl-1,3,4,5,6,7,8,8a-octahydronaphthalen-2-one

Manual Xrefs	Databases
78436651	ChemSpider