input word = C00017013

Metabolite InformationStructural formula
Name [1R-(1alpha,4aalpha,5alpha)]- 1-(Acetyloxy)-3,4,4a,5,6,7-hexahydro-4a,5-dimethyl-3-(1-methylethylidene)-2(1H)-naphthalenone
Formula C17H24O3
Mw 276.17254463
CAS RN 55050-19-6
C_ID C00017013 ,
InChIKey DBJHMMZCVHBKJQ-VTBBPJRINA-N
InChICode InChI=1S/C17H24O3/c1-10(2)13-9-17(5)11(3)7-6-8-14(17)16(15(13)19)20-12(4)18/h8,11,16H,6-7,9H2,1-5H3/t11-,16+,17+/m0/s1
SMILES C1CC=C2[C@@]([C@H]1C)(CC(=C(C)C)C(=O)[C@@H]2OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio elegans Ref.
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