21-脱氧皮质醇
TL;DR: 21-脱氧皮质醇 (CAS 641-77-0) is a chemical compound with molecular formula C21H30O4 and molecular weight 346.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
21-脱氧皮质醇
(8S,9S,10R,11S,13S,14S,17R)-17-acetyl-11,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 21-Deoxycortisol, 21-Deoxy Cortisol, 21-DESOXYCORTISOL, OXENOL, 21-Dehydrohydrocortisone
| Molecular Formula | C21H30O4 |
|---|---|
| Molecular Weight | 346.21 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.21442 |
| Heavy Atoms | 25 |
| Complexity | 667.0 |
Chemical Identifiers
| CAS Number | 641-77-0 |
|---|---|
| SMILES | CC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)O |
| InChIKey | LCZBQMKVFQNSJR-UJPCIWJBSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
21-脱氧皮质醇 (CAS 641-77-0), with molecular formula C21H30O4 and molecular weight 346.21 g/mol. IUPAC: (8S,9S,10R,11S,13S,14S,17R)-17-acetyl-11,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 21-脱氧皮质醇
Property Insights of 21-脱氧皮质醇
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 21-脱氧皮质醇. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 21-脱氧皮质醇. Following Lipinski's Rule of Five, 21-脱氧皮质醇 has 2 hydrogen bond donor(s) and 4 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 21-脱氧皮质醇?
The CAS number of 21-脱氧皮质醇 is 641-77-0.
What is the molecular formula of 21-脱氧皮质醇?
The molecular formula of 21-脱氧皮质醇 is C21H30O4.
What is the molecular weight of 21-脱氧皮质醇?
The molecular weight of 21-脱氧皮质醇 is 346.21 g/mol.
Where can I buy 21-脱氧皮质醇?
You can request a quote for 21-脱氧皮质醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 21-脱氧皮质醇?
Yes, KEHONG BIO provides custom synthesis services for 21-脱氧皮质醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.