input word = C00029388

Metabolite InformationStructural formula
Name 13,14-seco-Stigmasta-5,14-dien-3alpha-ol
Amarosterol A
Formula C29H50O
Mw 414.38616622
CAS RN 641630-42-4
C_ID C00029388 ,
InChIKey KWSDAMSVPQVEBE-IGUDHXGENA-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/h8-9,15,20-24,26-28,30H,7,10-14,16-19H2,1-6H3/b9-8+/t21-,22+,23-,24+,26-,27-,28+,29?/m1/s1
SMILES [C@H]12[C@H](CC=C3[C@@]1(CC[C@H](C3)O)C)/C=C/C[C@@H]([C@H](CC2)C)[C@@H](CC[C@H](C(C)C)CC)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaesalpinia bonduc Ref.
zoom in