YY6F8K37SB
TL;DR: YY6F8K37SB (CAS 57099-40-8) is a chemical compound with molecular formula C21H27O8P and molecular weight 438.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] dihydrogen phosphate
Also Known As: prednisone phosphate, Prednisone Impurity 7, 17-Hydroxy-21-Phosphonooxy-Pregna-1,4-Diene-3,11,20-Trione, Pregna-1,4-diene-3,11,20-trione, 17-hydroxy-21-(phosphonooxy)-, Pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxy-, 21-phosphate
| Molecular Formula | C21H27O8P |
|---|---|
| Molecular Weight | 438.14 g/mol |
| LogP | 1.8828 |
| Topological Polar Surface Area | 138.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.14435 |
| Heavy Atoms | 30 |
| Complexity | 931.29083 |
Chemical Identifiers
| CAS Number | 57099-40-8 |
|---|---|
| SMILES | C[C@]12CC(=O)[C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)COP(=O)(O)O)O)CCC4=CC(=O)C=C[C@]34C |
Product Overview
YY6F8K37SB (CAS 57099-40-8), with molecular formula C21H27O8P and molecular weight 438.14 g/mol. IUPAC: [2-[(8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] dihydrogen phosphate.
Chemical Property Profile of YY6F8K37SB
Property Insights of YY6F8K37SB
The XLogP value of 1.8828 suggests moderate lipophilicity, balancing water solubility and membrane permeability for YY6F8K37SB. The TPSA of 138.2 Ų falls within the moderate polarity range, balancing permeability and solubility for YY6F8K37SB. Following Lipinski's Rule of Five, YY6F8K37SB has 3 hydrogen bond donor(s) and 6 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 YY6F8K37SB?
The CAS number of YY6F8K37SB is 57099-40-8.
What is the molecular formula of YY6F8K37SB?
The molecular formula of YY6F8K37SB is C21H27O8P.
What is the molecular weight of YY6F8K37SB?
The molecular weight of YY6F8K37SB is 438.14 g/mol.
Where can I buy YY6F8K37SB?
You can request a quote for YY6F8K37SB directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for YY6F8K37SB?
Yes, KEHONG BIO provides custom synthesis services for YY6F8K37SB and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.