Icomethasone

CAS Registry Number®

4647-20-5

CAS Name

Icomethasone

Molecular Formula

C22H29ClO5

Molecular Mass

408.92

Cite this Page

Icomethasone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4647-20-5 (retrieved 2024-11-21) (CAS RN: 4647-20-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    229-234 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H29ClO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1

InChIKey

InChIKey=NBMKJKDGKREAPL-CXSFZGCWSA-N

SMILES

Cl[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1O)[C@](C(CO)=O)(O)[C@H](C)C3)[H])(CCC=4[C@]2(C)C=CC(=O)C4)[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C4CC(C)C(O)(C(=O)CO)C4(C)CC(O)C32Cl)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 9-chloro-11,17,21-trihydroxy-16-methyl-, (11β,16α)-
  • Pregna-1,4-diene-3,20-dione, 9-chloro-11β,17,21-trihydroxy-16α-methyl-
  • (11β,16α)-9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione
  • Icometasone
  • Icomethasone

CAS INSIGHTSTM
Targeted protein degrader structure, illustration