Tetrahydro-11-deoxycortisol

CAS Registry Number®

68-60-0

CAS Name

Tetrahydro-11-deoxycortisol

Molecular Formula

C21H34O4

Molecular Mass

350.49

Cite this Page

Tetrahydro-11-deoxycortisol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68-60-0 (retrieved 2024-11-25) (CAS RN: 68-60-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    224-226 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H34O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h13-17,22-23,25H,3-12H2,1-2H3/t13-,14-,15-,16+,17+,19+,20+,21+/m1/s1

InChIKey

InChIKey=UPTAPIKFKZGAGM-FAIYVORSSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@](CC3)(C[C@H](O)CC4)[H])(CC1)[H])[H])(CC[C@@]2(C(CO)=O)O)[H]

Canonical SMILES

O=C(CO)C1(O)CCC2C3CCC4CC(O)CCC4(C)C3CCC21C

Other Names for this Substance

  • Pregnan-20-one, 3,17,21-trihydroxy-, (3α,5β)-
  • 5β-Pregnan-20-one, 3α,17,21-trihydroxy-
  • (3α,5β)-3,17,21-Trihydroxypregnan-20-one
  • Reichstein's substance S, tetrahydro-
  • Tetrahydrocortexolone

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