Methylprednisolone 17-hemisuccinate
TL;DR: Methylprednisolone 17-hemisuccinate (CAS 77074-42-1) is a chemical compound with molecular formula C26H34O8 and molecular weight 474.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(6S,8S,9S,10R,11S,13S,14S,17R)-11-hydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]oxy]-4-oxobutanoic acid
Also Known As: Methylprednisolone 17-hemisuccinate, 6a-Methyl Prednisolone 17-Hemisuccinate, 6alpha-Methyl Prednisolone 17-Hemisuccinate, Methylprednisolone 17-Hydrogen Succinate, A-Methyl Prednisolone 17-Hemisuccinate
| Molecular Formula | C26H34O8 |
|---|---|
| Molecular Weight | 474.23 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 474.22537 |
| Heavy Atoms | 34 |
| Complexity | 981.0 |
Chemical Identifiers
| CAS Number | 77074-42-1 |
|---|---|
| SMILES | C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)CO)OC(=O)CCC(=O)O |
| InChIKey | VDJNUHGXSJAWMH-XYMSELFBSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methylprednisolone 17-hemisuccinate (CAS 77074-42-1), with molecular formula C26H34O8 and molecular weight 474.23 g/mol. IUPAC: 4-[[(6S,8S,9S,10R,11S,13S,14S,17R)-11-hydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]oxy]-4-oxobutanoic acid.
Chemical Property Profile of Methylprednisolone 17-hemisuccinate
Property Insights of Methylprednisolone 17-hemisuccinate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methylprednisolone 17-hemisuccinate. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methylprednisolone 17-hemisuccinate. Following Lipinski's Rule of Five, Methylprednisolone 17-hemisuccinate has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methylprednisolone 17-hemisuccinate?
The CAS number of Methylprednisolone 17-hemisuccinate is 77074-42-1.
What is the molecular formula of Methylprednisolone 17-hemisuccinate?
The molecular formula of Methylprednisolone 17-hemisuccinate is C26H34O8.
What is the molecular weight of Methylprednisolone 17-hemisuccinate?
The molecular weight of Methylprednisolone 17-hemisuccinate is 474.23 g/mol.
Where can I buy Methylprednisolone 17-hemisuccinate?
You can request a quote for Methylprednisolone 17-hemisuccinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylprednisolone 17-hemisuccinate?
Yes, KEHONG BIO provides custom synthesis services for Methylprednisolone 17-hemisuccinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.