(3β,16α)-3-Hydroxy-16-methylpregn-5-en-20-one

CAS Registry Number®

16394-71-1
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CAS Name

(3β,16α)-3-Hydroxy-16-methylpregn-5-en-20-one

Molecular Formula

C22H34O2

Molecular Mass

330.50

Cite this Page

(3β,16α)-3-Hydroxy-16-methylpregn-5-en-20-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=16394-71-1 (retrieved 2024-09-07) (CAS RN: 16394-71-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    184-187 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H34O2/c1-13-11-19-17-6-5-15-12-16(24)7-9-21(15,3)18(17)8-10-22(19,4)20(13)14(2)23/h5,13,16-20,24H,6-12H2,1-4H3/t13-,16+,17-,18+,19+,20-,21+,22+/m1/s1

InChIKey

InChIKey=XXSFRYVGIQYVIQ-RDTLVLTASA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(=CC3)C[C@@H](O)CC4)(CC1)[H])[H])(C[C@@H](C)[C@@H]2C(C)=O)[H]

Canonical SMILES

O=C(C)C1C(C)CC2C3CC=C4CC(O)CCC4(C)C3CCC12C

Other Names for this Substance

  • Pregn-5-en-20-one, 3-hydroxy-16-methyl-, (3β,16α)-
  • Pregn-5-en-20-one, 3β-hydroxy-16α-methyl-
  • (3β,16α)-3-Hydroxy-16-methylpregn-5-en-20-one
  • 16α-Methylpregnenolone
  • 3β-Hydroxy-16α-methylpregn-5-en-20-one

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