CAS Registry Number®
976-70-5
CAS Name
Pregn-4-ene-21-carboxylic acid, 17-hydroxy-3-oxo-, γ-lactone, (17α)-
Molecular Formula
C22H30O3
Molecular Mass
342.47
Compound Properties
-
Melting Point (1)
156-159 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C22H30O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h13,16-18H,3-12H2,1-2H3/t16-,17+,18+,20+,21+,22-/m1/s1
InChIKey
InChIKey=UWBICEKKOYXZRG-WNHSNXHDSA-N
SMILES
C[C@@]12[C@]3(CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(CC4)=CC(=O)CC5)[H])[H])[H])OC(=O)CC3
Canonical SMILES
O=C1OC2(CC1)CCC3C4CCC5=CC(=O)CCC5(C)C4CCC32C
Other Names for this Substance
- Pregn-4-ene-21-carboxylic acid, 17-hydroxy-3-oxo-, γ-lactone, (17α)-
- 17α-Pregn-4-ene-21-carboxylic acid, 17-hydroxy-3-oxo-, γ-lactone
- SC 5233
- 3-(3-Oxo-17β-hydroxy-4-androsten-17-yl)propionic acid γ-lactone
- 3-(3-Oxo-17β-hydroxyandrost-4-en-17α-yl)propiolactone
- 3′-(3-Oxo-17β-hydroxyandrost-4-en-17α-yl)-propionic acid lactone
- 6,7-Dihydrocanrenone
- 17β-Hydroxy-3-oxopregn-4-en-21-carboxylic acid γ-lactone
