Guggulsterone

CAS Registry Number®

95975-55-6
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CAS Name

Guggulsterone

Molecular Formula

C21H28O2

Molecular Mass

312.45

Cite this Page

Guggulsterone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=95975-55-6 (retrieved 2024-03-28) (CAS RN: 95975-55-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H28O2/c1-4-16-19(23)12-18-15-6-5-13-11-14(22)7-9-20(13,2)17(15)8-10-21(16,18)3/h4,11,15,17-18H,5-10,12H2,1-3H3/t15-,17+,18+,20+,21-/m1/s1

InChIKey

InChIKey=WDXRGPWQVHZTQJ-NRJJLHBYSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)CC4)(CC1)[H])[H])(CC(=O)C2=CC)[H]

Canonical SMILES

O=C1C=C2CCC3C4CC(=O)C(=CC)C4(C)CCC3C2(C)CC1

Other Names for this Substance

  • Pregna-4,17(20)-diene-3,16-dione
  • Guggulsterone
  • Gugulipid
  • Z/E-Guggulsterone
  • Guglip

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