input word = C00036017

Metabolite InformationStructural formula
Name 6,7-Dehydroroyleanone
Formula C20H26O3
Mw 314.1881947
CAS RN 6855-99-8
C_ID C00036017 ,
InChIKey UAZRHHCHUYOJQV-SMZHUMLNNA-N
InChICode InChI=1S/C20H26O3/c1-11(2)14-16(21)12-7-8-13-19(3,4)9-6-10-20(13,5)15(12)18(23)17(14)22/h7-8,11,13,22H,6,9-10H2,1-5H3/t13-,20-/m0/s1
SMILES CC(C)C1=C(O)C(=O)C2=C(C=C[C@H]3C(C)(C)CCC[C@]23C)C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataePlectranthus lanuginosus Ref.
PlantaeLabiataeSalvia bracteata Banks and Sol. Ref.
PlantaeLabiataeSalvia eriophora Boiss and Kotschy Ref.
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OrganismPlectranthus lanuginosus
ReferenceSchmid,Helv.Chim.Acta,62,(1982),2136