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

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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 (1RS,6SR,10SR)-6,10-dimethylbicyclo[4.4.0]decan-3-one
ChEBI ID CHEBI:200698
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H20O
Net Charge 0
Average Mass 180.291
Monoisotopic Mass 180.15142
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
SMILES O=C1C[C@@H]2[C@@](CCC[C@H]2C)(C)CC1
Metabolite of Species Details
Chondromyces crocatus (NCBI:txid52) See: DOI
ChEBI Ontology
Outgoing (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 Xref Database
78436651 ChemSpider
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