(17β)-3-Oxoandrost-4-ene-17-carboxylic acid

CAS Registry Number®

302-97-6

CAS Name

(17β)-3-Oxoandrost-4-ene-17-carboxylic acid

Molecular Formula

C20H28O3

Molecular Mass

316.43

Cite this Page

(17β)-3-Oxoandrost-4-ene-17-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=302-97-6 (retrieved 2024-11-22) (CAS RN: 302-97-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    260 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H28O3/c1-19-9-7-13(21)11-12(19)3-4-14-15-5-6-17(18(22)23)20(15,2)10-8-16(14)19/h11,14-17H,3-10H2,1-2H3,(H,22,23)/t14-,15-,16-,17+,19-,20-/m0/s1

InChIKey

InChIKey=YQACAXHKQZCEOI-UDCWSGSHSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@H](C(O)=O)CC4)[H])(CCC1=CC(=O)CC2)[H])[H]

Canonical SMILES

O=C1C=C2CCC3C(CCC4(C)C(C(=O)O)CCC34)C2(C)CC1

Other Names for this Substance

  • Androst-4-ene-17-carboxylic acid, 3-oxo-, (17β)-
  • Androst-4-ene-17β-carboxylic acid, 3-oxo-
  • (17β)-3-Oxoandrost-4-ene-17-carboxylic acid
  • Etienic acid
  • 3-Oxoandrost-4-ene-17β-carboxylic acid

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CAS INSIGHTSTM
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