(3β,5α,16β)-3,16-Dihydroxypregnan-20-one
CAS Registry Number®
20745-29-3
CAS Name
(3β,5α,16β)-3,16-Dihydroxypregnan-20-oneMolecular Formula
C21H34O3Molecular Mass
334.49Cite this Page
(3β,5α,16β)-3,16-Dihydroxypregnan-20-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=20745-29-3 (retrieved ) (CAS RN: 20745-29-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
255-258 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C21H34O3/c1-12(22)19-18(24)11-17-15-5-4-13-10-14(23)6-8-20(13,2)16(15)7-9-21(17,19)3/h13-19,23-24H,4-11H2,1-3H3/t13-,14-,15+,16-,17-,18-,19-,20-,21-/m0/s1
InChIKey
InChIKey=FGDFFHLIMDMCJI-AFYPPJMBSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@@](CC3)(C[C@@H](O)CC4)[H])(CC1)[H])[H])(C[C@H](O)[C@@H]2C(C)=O)[H]
Canonical SMILES
O=C(C)C1C(O)CC2C3CCC4CC(O)CCC4(C)C3CCC12C
Other Names for this Substance
- Pregnan-20-one, 3,16-dihydroxy-, (3β,5α,16β)-
- 5α-Pregnan-20-one, 3β,16β-dihydroxy-
- (3β,5α,16β)-3,16-Dihydroxypregnan-20-one
- 3β,16β-Dihydroxy-5α-pregnan-20-one
- Lycopersiconol
