input word = C00050014

Metabolite InformationStructural formula
Name Bridgesigenin C
Formula C32H48O6
Mw 528.34508926
CAS RN 172923-93-2
C_ID C00050014 ,
InChIKey OYRFLMWYDCFMIQ-HCYHQZKGNA-N
InChICode InChI=1S/C32H48O6/c1-18(34)37-24-15-32-16-25(38-26(32)36)31(7)19(20(32)14-28(24,4)17-33)8-9-22-29(5)12-11-23(35)27(2,3)21(29)10-13-30(22,31)6/h8,20-25,33,35H,9-17H2,1-7H3/t20-,21-,22+,23-,24-,25+,28-,29-,30+,31-,32-/m0/s1
SMILES CC(=O)O[C@H]1C[C@@]23C[C@@H](OC2=O)[C@]2(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]42C)[C@@H]3C[C@@]1(C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Trichoereus pachanoi Ref.
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