Pregnan-20-one, 16,17-epoxy-3-hydroxy-, (3β,5β,16α)-
CAS Registry Number®
1044-90-2
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CAS Name
Pregnan-20-one, 16,17-epoxy-3-hydroxy-, (3β,5β,16α)-Molecular Formula
C21H32O3Molecular Mass
332.48Cite this Page
Pregnan-20-one, 16,17-epoxy-3-hydroxy-, (3β,5β,16α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1044-90-2 (retrieved ) (CAS RN: 1044-90-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
220-222 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C21H32O3/c1-12(22)21-18(24-21)11-17-15-5-4-13-10-14(23)6-8-19(13,2)16(15)7-9-20(17,21)3/h13-18,23H,4-11H2,1-3H3/t13-,14+,15-,16+,17+,18-,19+,20+,21-/m1/s1
InChIKey
InChIKey=MSGQPOBWYUXEOQ-JEKXPXOESA-N
SMILES
C(C)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(O2)[H])([C@]4([C@](CC3)([C@]5(C)[C@](CC4)(C[C@@H](O)CC5)[H])[H])[H])[H]
Canonical SMILES
O=C(C)C12OC2CC3C4CCC5CC(O)CCC5(C)C4CCC31C
Other Names for this Substance
- Pregnan-20-one, 16,17-epoxy-3-hydroxy-, (3β,5β,16α)-
- 5β-Pregnan-20-one, 16α,17-epoxy-3β-hydroxy-
- 16,17-Epoxy-17H-cyclopenta[a]phenanthrene, pregnan-20-one deriv.
- NSC 21458
