input word = C00036471

Metabolite InformationStructural formula
Name 24,25-Epoxy-3beta,23-dihydroxy-7-tirucallene
Dihydroniloticin
Formula C30H50O3
Mw 458.37599546
CAS RN 115334-05-9
C_ID C00036471 ,
InChIKey UMTABACRBSGXGK-JCAQOFCINA-N
InChICode InChI=1S/C30H50O3/c1-18(17-22(31)25-27(4,5)33-25)19-11-15-30(8)21-9-10-23-26(2,3)24(32)13-14-28(23,6)20(21)12-16-29(19,30)7/h9,18-20,22-25,31-32H,10-17H2,1-8H3/t18-,19-,20-,22+,23-,24-,25-,28+,29-,30+/m0/s1
SMILES C[C@@H](C[C@@H](O)[C@@H]1OC1(C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeDysoxylum hainanense Ref.
PlantaeRutaceaePhellodendron amurense Ref.
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