Cortisol sulfate

CAS Registry Number®

1253-43-6

CAS Name

Cortisol sulfate

Molecular Formula

C21H30O8S

Molecular Mass

442.52

Cite this Page

Cortisol sulfate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1253-43-6 (retrieved 2024-11-22) (CAS RN: 1253-43-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H30O8S/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19/h9,14-16,18,23,25H,3-8,10-11H2,1-2H3,(H,26,27,28)/t14-,15-,16-,18+,19-,20-,21-/m0/s1

InChIKey

InChIKey=JOVLCJDINAUYJW-VWUMJDOOSA-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(=O)(=O)O)=O)O)[H]

Canonical SMILES

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

Other Names for this Substance

  • Pregn-4-ene-3,20-dione, 11,17-dihydroxy-21-(sulfooxy)-, (11β)-
  • Cortisol, 21-(hydrogen sulfate)
  • (11β)-11,17-Dihydroxy-21-(sulfooxy)pregn-4-ene-3,20-dione
  • Cortisol sulfate
  • Cortisol 21-sulfate

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration