input word = C00059333

Metabolite InformationStructural formula
Name Triptonodiol
Formula C21H30O4
Mw 346.21440945
CAS RN 117456-87-8
C_ID C00059333
InChIKey XGRBHDJWRPUKMD-TYCQWZJGSA-N
InChICode InChI=1S/C21H30O4/c1-12(2)14-10-15(23)18-13(19(14)25-5)6-7-16-20(18,3)9-8-17(24)21(16,4)11-22/h10,12,16,22-23H,6-9,11H2,1-5H3/t16-,20+,21-/m1/s1
SMILES COc1c(C(C)C)cc(O)c2c1CCC1C(C)(CO)C(=O)CCC21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium wilfordii Ref.
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