Cortol

CAS Registry Number®

516-38-1

CAS Name

Cortol

Molecular Formula

C21H36O5

Molecular Mass

368.51

Cite this Page

Cortol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=516-38-1 (retrieved 2024-11-29) (CAS RN: 516-38-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17+,18-,19+,20+,21+/m1/s1

InChIKey

InChIKey=FFPUNPBUZDTHJI-XPOJVAQCSA-N

SMILES

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

Canonical SMILES

OCC(O)C1(O)CCC2C3CCC4CC(O)CCC4(C)C3C(O)CC21C

Other Names for this Substance

  • Pregnane-3,11,17,20,21-pentol, (3α,5β,11β,20S)-
  • 5β-Pregnane-3α,11β,17,20α,21-pentol
  • (3α,5β,11β,20S)-Pregnane-3,11,17,20,21-pentol
  • Cortol
  • α-Cortol

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