input word = C00040814

Metabolite InformationStructural formula
Name 3alpha,20-Dihydroxy-3beta,25-epoxylupane
(+)-3alpha,20-Dihydroxy-3beta,25-epoxylupane
Formula C30H50O3
Mw 458.37599546
CAS RN 220599-52-0
C_ID C00040814 ,
InChIKey VOBKGUCJBJCPIW-NYZKNUPPNA-N
InChICode InChI=1S/C30H50O3/c1-24(2)21-11-13-28(7)22(29(21)16-17-30(24,32)33-18-29)9-8-20-23-19(25(3,4)31)10-12-26(23,5)14-15-27(20,28)6/h19-23,31-32H,8-18H2,1-7H3/t19-,20-,21+,22+,23+,26-,27-,28-,29-,30+/m1/s1
SMILES C1[C@]2(C([C@H]3[C@](C1)([C@@H]1[C@@](CC3)([C@]3([C@H](CC1)[C@H]1[C@@](CC3)(CC[C@H]1C(C)(O)C)C)C)C)CO2)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeRhus typhina Ref.
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