Tetrahydrocortisol
CAS Registry Number®
53-02-1
No image available.
CAS Name
TetrahydrocortisolMolecular Formula
C21H34O5Molecular Mass
366.49Cite this Page
Tetrahydrocortisol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=53-02-1 (retrieved ) (CAS RN: 53-02-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
215-217 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C21H34O5/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/h12-16,18,22-24,26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,18-,19+,20+,21+/m1/s1
InChIKey
InChIKey=AODPIQQILQLWGS-GXBDJPPSSA-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(CO)=O)O)[H]
Canonical SMILES
O=C(CO)C1(O)CCC2C3CCC4CC(O)CCC4(C)C3C(O)CC21C
Other Names for this Substance
- Pregnan-20-one, 3,11,17,21-tetrahydroxy-, (3α,5β,11β)-
- 5β-Pregnan-20-one, 3α,11β,17,21-tetrahydroxy-
- (3α,5β,11β)-3,11,17,21-Tetrahydroxypregnan-20-one
- Cortisol, tetrahydro-
- 5β-Pregnane-3α,11β,17α,21-tetrol-20-one
