Pregn-4-ene-3,20-dione, 12-(chloromethyl)-12-hydroxy-, (12β)-

CAS Registry Number®

7255-84-7

CAS Name

Pregn-4-ene-3,20-dione, 12-(chloromethyl)-12-hydroxy-, (12β)-

Molecular Formula

C22H31ClO3

Molecular Mass

378.93

Cite this Page

Pregn-4-ene-3,20-dione, 12-(chloromethyl)-12-hydroxy-, (12β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7255-84-7 (retrieved 2024-11-22) (CAS RN: 7255-84-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H31ClO3/c1-13(24)17-6-7-18-16-5-4-14-10-15(25)8-9-20(14,2)19(16)11-22(26,12-23)21(17,18)3/h10,16-19,26H,4-9,11-12H2,1-3H3/t16-,17+,18-,19-,20-,21+,22-/m0/s1

InChIKey

InChIKey=LSUMZADQUYYJTQ-VUIPWDCGSA-N

SMILES

C[C@@]12[C@]([C@]3([C@](C[C@@]1(CCl)O)([C@]4(C)C(CC3)=CC(=O)CC4)[H])[H])(CC[C@@H]2C(C)=O)[H]

Canonical SMILES

O=C1C=C2CCC3C4CCC(C(=O)C)C4(C)C(O)(CCl)CC3C2(C)CC1

Other Names for this Substance

  • Pregn-4-ene-3,20-dione, 12-(chloromethyl)-12-hydroxy-, (12β)-
  • Pregn-4-ene-3,20-dione, 12α-(chloromethyl)-12-hydroxy-
  • NSC 74228

CAS INSIGHTSTM
Targeted protein degrader structure, illustration