input word = C00017511

Metabolite InformationStructural formula
Name 3beta-Acetoxycacalohastine
Formula C18H20O4
Mw 300.13615913
CAS RN 62706-45-0
C_ID C00017511 ,
InChIKey ZRFLKTSHIISUTA-UHFFFAOYNA-N
InChICode InChI=1S/C18H20O4/c1-9-8-21-18-15(9)11(3)16-10(2)14(22-12(4)19)7-6-13(16)17(18)20-5/h6-8,10,14H,1-5H3/t10-,14+/m0/s1
SMILES COc1c2c(c(C)c3c(C)coc13)C(C)C(OC(C)=O)C=C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio panduriformis Ref.
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