Structure

Cimigenol

CAS
3779-59-7
Catalog Number
ACM3779597
Category
Other Products
Molecular Weight
488.7
Molecular Formula
C30H48O5

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Specification

Synonyms
CIMIGENOL;(23R,24S)-16β,23:16α,24-Diepoxy-9β,19-cyclo-5α-lanostane-3β,15α,25-triol;Cimicifugol
Canonical SMILES
CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O
InChI
InChI=1S/C30H48O5/c1-16-14-17-22(25(4,5)33)35-30(34-17)21(16)26(6)12-13-29-15-28(29)11-10-20(31)24(2,3)18(28)8-9-19(29)27(26,7)23(30)32/h16-23,31-33H,8-15H2,1-7H3/t16-,17-,18+,19+,20+,21-,22-,23-,26-,27-,28-,29+,30-/m1/s1
InChI Key
CNBHUROFMYCHGI-JUBYRMABSA-N
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