input word = C00041128

Metabolite InformationStructural formula
Name Stigmastan-3-one
Formula C29H50O
Mw 414.38616622
CAS RN 102734-69-0
C_ID C00041128 ,
InChIKey BVVFRHKBULZQCQ-MRWDKNHRNA-N
InChICode InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h19-22,24-27H,7-18H2,1-6H3/t20-,21-,22+,24-,25-,26+,27+,28+,29-/m1/s1
SMILES CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaeLarix kaempferi (Lamb.) Carr Ref.
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