Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-, sodium salt (1:1), (5β)-
CAS Registry Number®
53-10-1
No image available.
CAS Name
Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-, sodium salt (1:1), (5β)-Molecular Formula
C25H36O6.NaCite this Page
Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-, sodium salt (1:1), (5β)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=53-10-1 (retrieved ) (CAS RN: 53-10-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
201 °C (decomp)
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C25H36O6.Na/c1-24-11-9-16(26)13-15(24)3-4-17-18-5-6-20(25(18,2)12-10-19(17)24)21(27)14-31-23(30)8-7-22(28)29;/h15,17-20H,3-14H2,1-2H3,(H,28,29);/t15-,17+,18+,19+,20-,24+,25+;/m1./s1
InChIKey
InChIKey=IUMTWEQQQMEHMW-OOFWROCWSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@](CC3)(CC(=O)CC4)[H])(CC1)[H])[H])(CC[C@@H]2C(COC(CCC(O)=O)=O)=O)[H].[Na]
Canonical SMILES
[Na].O=C(O)CCC(=O)OCC(=O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C
Other Names for this Substance
- Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-, sodium salt (1:1), (5β)-
- 5β-Pregnane-3,20-dione, 21-hydroxy-, hydrogen succinate sodium salt
- Pregnane-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-, sodium salt, (5β)-
- 5β-Pregnane-3,20-dione, 21-hydroxy-, succinate, sodium salt
- Succinic acid, monoester with 21-hydroxy-5β-pregnane-3,20-dione, sodium salt
Deleted or Replaced CAS Registry Numbers
60187-23-7
