5α-Tetrahydrocortisol
CAS Registry Number®
302-91-0
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CAS Name
5α-TetrahydrocortisolMolecular Formula
C21H34O5Molecular Mass
366.49Cite this Page
5α-Tetrahydrocortisol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=302-91-0 (retrieved ) (CAS RN: 302-91-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
244.5 °CDensity (2)
1.205 g/cm³
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Norton, Dorita A.; Acta Crystallographica, (1962), 15, 918, CAplus
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-/m0/s1
InChIKey
InChIKey=AODPIQQILQLWGS-FDSHTENPSA-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,5α,11β)-
- 5α-Pregnan-20-one, 3α,11β,17,21-tetrahydroxy-
- (3α,5α,11β)-3,11,17,21-Tetrahydroxypregnan-20-one
- Allopregnane-3α,11β,17α,21-tetrol-20-one
- Allotetrahydrocompound F
