9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione
TL;DR: 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione (CAS 38469-83-9) is a chemical compound with molecular formula C21H29FO6 and molecular weight 396.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9R,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: Pretriamcinolone, Triamcinolone impurity C, 1,2-Dihydrotriamcinolone, Triamcinolone EP Impurity C, 1,2-Dihydro Triamcinolone
| Molecular Formula | C21H29FO6 |
|---|---|
| Molecular Weight | 396.19 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 396.19482 |
| Heavy Atoms | 28 |
| Complexity | 766.0 |
Chemical Identifiers
| CAS Number | 38469-83-9 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3C[C@H]([C@@]4(C(=O)CO)O)O)C)O)F |
| InChIKey | SXQQMCLQCSKJNC-OBYCQNJPSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione (CAS 38469-83-9), with molecular formula C21H29FO6 and molecular weight 396.19 g/mol. IUPAC: (8S,9R,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione
Property Insights of 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione. Following Lipinski's Rule of Five, 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione has 4 hydrogen bond donor(s) and 7 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 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione?
The CAS number of 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione is 38469-83-9.
What is the molecular formula of 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione?
The molecular formula of 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione is C21H29FO6.
What is the molecular weight of 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione?
The molecular weight of 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione is 396.19 g/mol.
Where can I buy 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione?
You can request a quote for 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 9-Fluoro-11beta,16alpha,17,21-tetrahydroxypregn-4-ene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.