input word = C00029389

Metabolite InformationStructural formula
Name 13,14-seco-Stigmasta-9(11),14-dien-3alpha-ol
Amarosterol B
Formula C29H50O
Mw 414.38616622
CAS RN 641630-43-5
C_ID C00029389 ,
InChIKey HKYYLANUJNZBFK-YRXYMMDLNA-N
InChICode InChI=1S/C29H50O/c1-7-23(20(2)3)13-11-21(4)27-10-8-9-24-14-15-25-19-26(30)17-18-29(25,6)28(24)16-12-22(27)5/h8-9,16,20-27,30H,7,10-15,17-19H2,1-6H3/b9-8+,28-16+/t21-,22+,23-,24-,25+,26-,27-,29+/m1/s1
SMILES C\1/2=C\C[C@@H]([C@H](C/C=C/[C@@H]1CC[C@@H]1[C@@]2(CC[C@H](C1)O)C)[C@@H](CC[C@H](C(C)C)CC)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaesalpinia bonduc Ref.
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