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Hydrocortisone Sodium Succinate
CAS: 125-04-2 | C25H34NaO8
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
125-04-2
Molecular Formula:
C25H34NaO8
Molecular Mass:
485.53 g/mol
Names and Synonyms:
Hydrocortisone Sodium Succinate
Pregn-4-ene-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-11,17-dihydroxy-, sodium salt (1:1), (11β)-
Cortisol, 21-(hydrogen succinate), monosodium salt
Pregn-4-ene-3,20-dione, 21-(3-carboxy-1-oxopropoxy)-11,17-dihydroxy-, monosodium salt, (11β)-
Cortisol, hydrogen succinate, sodium salt
Cortisol, succinate, sodium salt
Corlan
Cortisol sodium succinate
EF-Cortelan Soluble
Hydrocortisone 21-hemisuccinate sodium salt
Hydrocortisone hemisuccinate sodium salt
Hydrocortisone sodium hemisuccinate
Hydrocortisone sodium succinate
Sodium hydrocortisone 21-hemisuccinate
Sodium hydrocortisone succinate
Sodium 17-hydroxycorticosterone 21-succinate
Solu-Cortef
Cortisol 21-sodium succinate
U 4905
Sodium hydrocortisone 21-succinate
Hydrocortisone 21-sodium succinate
Hydrocortisone sodium 21-hemisuccinate
Cortisol hemisuccinate sodium salt
Hydrocortisone 21-sodium succinide
Buccalsone
Solu-Glyc
Intracort
Nordicort
Flebocortid
Emi-Corlin
Oralsone
Cortisol sodium hemisuccinate
Hydrocortisone 21-succinate sodium salt
A-HydroCort
Identifiers:
SMILES:
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)COC(=O)CCC(=O)O.[Na]
InChI:
InChI=1S/C25H34O8.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;/h11,16-18,22,27,32H,3-10,12-13H2,1-2H3,(H,29,30);/t16-,17-,18-,22+,23-,24-,25-;/m0./s1
Key Properties
Melting Point
169-172 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 485.53 g/mol | CAS Common Chemistry |
| 485.5290000000004 g/mol | RDKit | |
| 485.21513732799986 g/mol | RDKit | |
| Canonical SMILES | [Na].O=C(O)CCC(=O)OCC(=O)C1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3C(O)CC21C | CAS Common Chemistry |
| InChI | InChI=1S/C25H34O8.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;/h11,16-18,22,27,32H,3-10,12-13H2,1-2H3,(H,29,30);/t16-,17-,18-,22+,23-,24-,25-;/m0./s1 | CAS Common Chemistry |
| InChI Key | InChIKey=LGKJVUKNTHOZJH-CODXZCKSSA-N | CAS Common Chemistry |
| Melting Point | 169-172 °C | CAS Common Chemistry |
| Name | Hydrocortisone sodium succinate | CAS Common Chemistry |
| Heavy Atom Count | 34 | RDKit |
| Hydrogen Bond Acceptors | 7 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 138.2 Ų | RDKit |
| LogP | 1.8165 | RDKit |
| Molar Refractivity | 121.63940000000008 | RDKit |
