Pregnane-3,20-dione

CAS Registry Number®

7350-00-7

CAS Name

Pregnane-3,20-dione

Molecular Formula

C21H32O2

Molecular Mass

316.48

Cite this Page

Pregnane-3,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7350-00-7 (retrieved 2025-02-22) (CAS RN: 7350-00-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    118-120 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14,16-19H,4-12H2,1-3H3/t14?,16-,17+,18-,19-,20-,21+/m0/s1

InChIKey

InChIKey=XMRPGKVKISIQBV-CVHNGYJVSA-N

SMILES

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

Canonical SMILES

O=C1CCC2(C)C(C1)CCC3C4CCC(C(=O)C)C4(C)CCC32

Other Names for this Substance

  • Pregnane-3,20-dione

CAS INSIGHTSTM
Samples on a microarray, illustration