16-Methylhydrocortisone
TL;DR: 16-Methylhydrocortisone (CAS 2294-17-9) is a chemical compound with molecular formula C22H32O5 and molecular weight 376.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,11R,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: 16-Methylhydrocortisone, 11,17,21-trihydroxy-16-methylpregn-4-ene-3,20-dione, 11alpha,17,21-Trihydroxy-16-methylpregn-4-ene-3,20-dione, (8S,9S,10R,11R,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
| Molecular Formula | C22H32O5 |
|---|---|
| Molecular Weight | 376.22 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.22498 |
| Heavy Atoms | 27 |
| Complexity | 713.0 |
Chemical Identifiers
| CAS Number | 2294-17-9 |
|---|---|
| SMILES | CC1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@]4([C@H]3[C@@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)C |
| InChIKey | ZCAYUOKEIPMTMF-SRYLXOBDSA-N |
Product Overview
16-Methylhydrocortisone (CAS 2294-17-9), with molecular formula C22H32O5 and molecular weight 376.22 g/mol. IUPAC: (8S,9S,10R,11R,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 16-Methylhydrocortisone
Property Insights of 16-Methylhydrocortisone
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 16-Methylhydrocortisone. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 16-Methylhydrocortisone. Following Lipinski's Rule of Five, 16-Methylhydrocortisone has 3 hydrogen bond donor(s) and 5 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 16-Methylhydrocortisone?
The CAS number of 16-Methylhydrocortisone is 2294-17-9.
What is the molecular formula of 16-Methylhydrocortisone?
The molecular formula of 16-Methylhydrocortisone is C22H32O5.
What is the molecular weight of 16-Methylhydrocortisone?
The molecular weight of 16-Methylhydrocortisone is 376.22 g/mol.
Where can I buy 16-Methylhydrocortisone?
You can request a quote for 16-Methylhydrocortisone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 16-Methylhydrocortisone?
Yes, KEHONG BIO provides custom synthesis services for 16-Methylhydrocortisone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.