Cimigenol

For research use only. Not for therapeutic Use.

  • CAT Number: I018339
  • CAS Number: 3779-59-7
  • Molecular Formula: C30H48O5
  • Molecular Weight: 488.70
  • Purity: ≥95%
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Cimigenol is an active compound isolated from Cimicifuga, with potent anti-tumor activity[1].


Catalog Number I018339
CAS Number 3779-59-7
Synonyms

(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-2,9-diol

Molecular Formula C30H48O5
Purity ≥95%
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
InChIKey CNBHUROFMYCHGI-IEUUZZHOSA-N
SMILES CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)O)C)O2)C(C)(C)O
Reference

[1]. Sakurai N, et al. Cancer preventive agents. Part 1: chemopreventive potential of cimigenol, cimigenol-3,15-dione, and related compounds. Bioorg Med Chem. 2005 Feb 15;13(4):1403-8.
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