Cholestan-3-one, 14-methyl-, (5α)-

CAS Registry Number®

54411-55-1

CAS Name

Cholestan-3-one, 14-methyl-, (5α)-

Molecular Formula

C28H48O

Molecular Mass

400.68

Cite this Page

Cholestan-3-one, 14-methyl-, (5α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54411-55-1 (retrieved 2025-03-12) (CAS RN: 54411-55-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    161-162 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C28H48O/c1-19(2)8-7-9-20(3)23-13-16-28(6)25-11-10-21-18-22(29)12-15-26(21,4)24(25)14-17-27(23,28)5/h19-21,23-25H,7-18H2,1-6H3/t20-,21+,23-,24+,25-,26+,27-,28+/m1/s1

InChIKey

InChIKey=ZMYBKDLUDWAJSA-DPLNCCJLSA-N

SMILES

C[C@]12[C@]3([C@@]([C@]4(C)[C@@](CC3)(CC(=O)CC4)[H])(CC[C@]1(C)[C@@]([C@@H](CCCC(C)C)C)(CC2)[H])[H])[H]

Canonical SMILES

O=C1CCC2(C)C(C1)CCC3C2CCC4(C)C(CCC34C)C(C)CCCC(C)C

Other Names for this Substance

  • Cholestan-3-one, 14-methyl-, (5α)-

CAS INSIGHTSTM
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