Prednisolone sodium succinateProduct ingredient for Prednisolone hemisuccinate
- Name
- Prednisolone sodium succinate
- Drug Entry
- Prednisolone hemisuccinate
- Accession Number
- DBSALT001634
- Structure
- Synonyms
- Prednisolone 21-succinate sodium / Prednisolone 21-succinate sodium salt
- UNII
- 8223RR9DWF
- CAS Number
- 1715-33-9
- Weight
- Average: 482.505
Monoisotopic: 482.19166224 - Chemical Formula
- C25H31NaO8
- InChI Key
- FKKAEMQFOIDZNY-CODXZCKSSA-M
- InChI
- InChI=1S/C25H32O8.Na/c1-23-9-7-15(26)11-14(23)3-4-16-17-8-10-25(32,24(17,2)12-18(27)22(16)23)19(28)13-33-21(31)6-5-20(29)30;/h7,9,11,16-18,22,27,32H,3-6,8,10,12-13H2,1-2H3,(H,29,30);/q;+1/p-1/t16-,17-,18-,22+,23-,24-,25-;/m0./s1
- IUPAC Name
- sodium 4-{2-[(1R,3aS,3bS,9aR,9bS,10S,11aS)-1,10-dihydroxy-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethoxy}-4-oxobutanoate
- SMILES
- [Na+].[H][C@@]12CC[C@](O)(C(=O)COC(=O)CCC([O-])=O)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@]12C
- External Links
- ChemSpider
- 391985
- ChEMBL
- CHEMBL1412530
- Predicted Properties
Property Value Source Water Solubility 0.0506 mg/mL ALOGPS logP 2.28 ALOGPS logP 1.54 Chemaxon logS -4 ALOGPS pKa (Strongest Acidic) 3.66 Chemaxon pKa (Strongest Basic) -2.9 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 7 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 141.03 Å2 Chemaxon Rotatable Bond Count 7 Chemaxon Refractivity 129.38 m3·mol-1 Chemaxon Polarizability 47.25 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon