input word = C00038139

Metabolite InformationStructural formula
Name 12-Deoxy-7,7-dimethoxy-6-ketoroyleanone
Formula C22H30O5
Mw 374.20932407
CAS RN 244279-41-2
C_ID C00038139 ,
InChIKey FBIXXXXACRPEFX-DBHKEIOZNA-N
InChICode InChI=1S/C22H30O5/c1-12(2)13-11-14(23)15-16(17(13)24)22(26-6,27-7)19(25)18-20(3,4)9-8-10-21(15,18)5/h11-12,18H,8-10H2,1-7H3/t18-,21+/m0/s1
SMILES COC1(OC)C(=O)[C@H]2C(C)(C)CCC[C@]2(C)C2=C1C(=O)C(C(C)C)=CC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia nutans Ref.
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