input word = C00053794

Metabolite InformationStructural formula
Name Soyasapogenol F
Formula C30H50O3
Mw 458.37599546
CAS RN 104033-83-2
C_ID C00053794
InChIKey FAQHDLWADGCEMS-ZMNQYPNASA-N
InChICode InChI=1S/C30H50O3/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/h21-24,31-33H,8-18H2,1-7H3/t21-,22-,23+,24-,26-,27+,28-,29-,30-/m1/s1
SMILES O[C@H]1[C@]2(C)CC[C@@]3(C)[C@]4(C)CC[C@@]5([H])[C@](CO)(C)[C@@H](O)CC[C@]5(C)[C@@]4([H])CCC3=C2CC(C)(C)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMedicago sativa Ref.
PlantaeFabaceaeTrifolium pratense Ref.
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OrganismMedicago sativa
ReferenceRafinska, K., et al., Phytochem. Lett., 20, (2017), 520-539.