input word = C00064438

Metabolite InformationStructural formula
Name Guggulsterol V
Formula C29H50O4
Mw 462.37091008
CAS RN 6120-71-4
C_ID C00064438
InChIKey ZAEXAXAPTAFPCD-BSMCXZHXSA-N
InChICode InChI=1S/C29H50O4/c1-18(2)8-7-9-19(3)23-10-11-24-22-16-26(33-20(4)30)29(32)17-21(31)12-15-28(29,6)25(22)13-14-27(23,24)5/h18-19,21-26,31-32H,7-17H2,1-6H3/t19-,21+,22+,23-,24+,25+,26-,27-,28-,29+/m1/s1
SMILES CC(=O)OC1CC2C3CCC(C(C)CCCC(C)C)C3(C)CCC2C2(C)CCC(O)CC12O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBurseraceaeCommiphora mukul Ref.
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