Cortisol 21-mesylate

CAS Registry Number®

6677-96-9
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CAS Name

Cortisol 21-mesylate

Molecular Formula

C22H32O7S

Molecular Mass

440.55

Cite this Page

Cortisol 21-mesylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6677-96-9 (retrieved 2024-06-16) (CAS RN: 6677-96-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    186-187 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H32O7S/c1-20-8-6-14(23)10-13(20)4-5-15-16-7-9-22(26,18(25)12-29-30(3,27)28)21(16,2)11-17(24)19(15)20/h10,15-17,19,24,26H,4-9,11-12H2,1-3H3/t15-,16-,17-,19+,20-,21-,22-/m0/s1

InChIKey

InChIKey=AFMXNPUMXZCVGU-CWNVBEKCSA-N

SMILES

C[C@@]12[C@]([C@]3([C@]([C@@H](O)C1)([C@]4(C)C(CC3)=CC(=O)CC4)[H])[H])(CC[C@@]2(C(COS(C)(=O)=O)=O)O)[H]

Canonical SMILES

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

Other Names for this Substance

  • Pregn-4-ene-3,20-dione, 11,17-dihydroxy-21-[(methylsulfonyl)oxy]-, (11β)-
  • Cortisol, 21-methanesulfonate
  • (11β)-11,17-Dihydroxy-21-[(methylsulfonyl)oxy]pregn-4-ene-3,20-dione
  • Cortisol 21-mesylate
  • Hydrocortisone 21-mesylate

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