input word = C00057175

Metabolite InformationStructural formula
Name Sandosapogenol
Formula C30H48O3
Mw 456.3603454
CAS RN 186415-75-8
C_ID C00057175
InChIKey FAIBWMGLHJMWQD-RQTDQIRZSA-N
InChICode InChI=1S/C30H48O3/c1-25(2)16-20-19-8-9-22-27(4)12-11-23(32)28(5,18-31)21(27)10-13-30(22,7)29(19,6)15-14-26(20,3)24(33)17-25/h8,18,20-24,32-33H,9-17H2,1-7H3/t20-,21+,22+,23-,24-,26+,27-,28+,29+,30+/m0/s1
SMILES CC1(C[C@@H]([C@@]2(CC[C@]3([C@@]4(CC[C@]5([C@](C)([C@H](CC[C@@]5([C@]4(CC=C3[C@@]2(C1)[H])[H])C)O)C=O)[H])C)C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePhaseolus vulgaris Ref.
zoom in