input word = C00013225

Metabolite InformationStructural formula
Name (4aS-trans)-4,4a,5,6,7,8-hexahydro-4a,8-dimethyl-2(3H)-Naphthalenone
(+)-(6S,10S)-6,10-Dimethylbicyclo[4.4.0]dec-1-en-3-one
(+)-(S,S)-6,10-Dimethylbicyclo[4.4.0]dec-1-en-3-one
Formula C12H18O
Mw 178.1357652
CAS RN 39850-89-0
C_ID C00013225 ,
InChIKey KLTKQWRPJDRMTL-RKRUEEIYNA-N
InChICode InChI=1S/C12H18O/c1-9-4-3-6-12(2)7-5-10(13)8-11(9)12/h8-9H,3-7H2,1-2H3/t9-,12-/m0/s1
SMILES C12=CC(=O)CC[C@@]2(CCC[C@@H]1C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeVetiveria zizanioides Ref.
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