(6α,16β,17α)-17-Acetyl-6-methyl-16,24-cyclo-21-norchol-4-en-3-one

CAS Registry Number®

58212-84-3
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CAS Name

(6α,16β,17α)-17-Acetyl-6-methyl-16,24-cyclo-21-norchol-4-en-3-one

Molecular Formula

C26H38O2

Molecular Mass

382.58

Cite this Page

(6α,16β,17α)-17-Acetyl-6-methyl-16,24-cyclo-21-norchol-4-en-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=58212-84-3 (retrieved 2024-04-19) (CAS RN: 58212-84-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H38O2/c1-16-13-20-21(24(3)11-8-19(28)15-22(16)24)9-12-25(4)23(20)14-18-7-5-6-10-26(18,25)17(2)27/h15-16,18,20-21,23H,5-14H2,1-4H3/t16-,18+,20+,21-,23-,24+,25-,26-/m0/s1

InChIKey

InChIKey=OAICPORQJIVREU-SGCXAXHESA-N

SMILES

C(C)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(CCCC2)[H])([C@]4([C@](CC3)([C@]5(C)C([C@@H](C)C4)=CC(=O)CC5)[H])[H])[H]

Canonical SMILES

O=C1C=C2C(C)CC3C(CCC4(C)C3CC5CCCCC54C(=O)C)C2(C)CC1

Other Names for this Substance

  • 16,24-Cyclo-21-norchol-4-en-3-one, 17-acetyl-6-methyl-, (6α,16β,17α)-
  • (6α,16β,17α)-17-Acetyl-6-methyl-16,24-cyclo-21-norchol-4-en-3-one
  • Pentarane B
  • Mecigestone

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