input word = C00058742

Metabolite InformationStructural formula
Name Subprogenin B
Formula C30H48O5
Mw 488.35017464
CAS RN 138822-64-7
C_ID C00058742
InChIKey ZJZSSUXQPBSZBH-LKTXHGEGSA-N
InChICode InChI=1S/C30H48O5/c1-25-12-13-28(4)19(20(25)14-30(17-32,18-33)15-24(25)35)6-7-22-26(2)10-9-23(34)27(3,16-31)21(26)8-11-29(22,28)5/h6,20-23,31-34H,7-18H2,1-5H3/t20-,21+,22+,23-,25+,26-,27+,28+,29+/m0/s1
SMILES C[C@]12CC[C@H](O)[C@](C)(CO)[C@@H]1CC[C@]1(C)[C@@H]2CC=C2[C@@H]3CC(CO)(CO)CC(=O)[C@]3(C)CC[C@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeSophora subprostrata Ref.
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