硫酸皮质醇
TL;DR: 硫酸皮质醇 (CAS 1253-43-6) is a chemical compound with molecular formula C21H30O8S and molecular weight 442.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸皮质醇
[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hydrogen sulfate
Also Known As: Cortisol 21-sulfate, Cortisol sulfate, Cortisol-21-sulfate, F(K)S Cpd, SS441 Compound
| Molecular Formula | C21H30O8S |
|---|---|
| Molecular Weight | 442.17 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 442.16614 |
| Heavy Atoms | 30 |
| Complexity | 904.0 |
Chemical Identifiers
| CAS Number | 1253-43-6 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)COS(=O)(=O)O)O)C)O |
| InChIKey | JOVLCJDINAUYJW-VWUMJDOOSA-N |
Product Overview
硫酸皮质醇 (CAS 1253-43-6), with molecular formula C21H30O8S and molecular weight 442.17 g/mol. IUPAC: [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hydrogen sulfate.
Chemical Property Profile of 硫酸皮质醇
Property Insights of 硫酸皮质醇
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硫酸皮质醇. The TPSA of 147.0 Ų indicates high polarity, suggesting 硫酸皮质醇 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸皮质醇 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 硫酸皮质醇?
The CAS number of 硫酸皮质醇 is 1253-43-6.
What is the molecular formula of 硫酸皮质醇?
The molecular formula of 硫酸皮质醇 is C21H30O8S.
What is the molecular weight of 硫酸皮质醇?
The molecular weight of 硫酸皮质醇 is 442.17 g/mol.
Where can I buy 硫酸皮质醇?
You can request a quote for 硫酸皮质醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸皮质醇?
Yes, KEHONG BIO provides custom synthesis services for 硫酸皮质醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.