(11β)-11,21-Dihydroxypregna-4,17(20)-dien-3-one

CAS Registry Number®

3494-53-9

CAS Name

(11β)-11,21-Dihydroxypregna-4,17(20)-dien-3-one

Molecular Formula

C21H30O3

Molecular Mass

330.46

Cite this Page

(11β)-11,21-Dihydroxypregna-4,17(20)-dien-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3494-53-9 (retrieved 2024-11-08) (CAS RN: 3494-53-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    182-186 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H30O3/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,11,16-19,22,24H,3-7,9-10,12H2,1-2H3/t16-,17-,18-,19+,20-,21+/m0/s1

InChIKey

InChIKey=SBMHTRUNPKWTLU-LEZSPFLNSA-N

SMILES

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

Canonical SMILES

O=C1C=C2CCC3C4CCC(=CCO)C4(C)CC(O)C3C2(C)CC1

Other Names for this Substance

  • Pregna-4,17(20)-dien-3-one, 11,21-dihydroxy-, (11β)-
  • Pregna-4,17(20)-dien-3-one, 11β,21-dihydroxy-
  • (11β)-11,21-Dihydroxypregna-4,17(20)-dien-3-one
  • 11β,21-Dihydroxy-4,17(20)-pregnadien-3-one

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles