C26H31FO7
TL;DR: C26H31FO7 (CAS 60864-53-1) is a chemical compound with molecular formula C26H31FO9 and molecular weight 506.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2S,8R,10S,11S,13S,15S)-14-(carboxymethyl)-8-fluoro-12-hydroxy-2,13,15-trimethyl-5-oxo-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadeca-3,6-dien-14-yl]-3-hydroxy-4-oxobutanoic acid
Also Known As: EINECS 262-492-5, 9beta,11alpha-Epoxy-6beta-fluoro-17,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 17,21-di(acetate), 17-(3-Carboxy-2-hydroxypropanoyl)-6-fluoro-15-hydroxy-16-methyl-3-oxo-9,11-epoxypregna-1,4-dien-21-oic acid, 4-[(4aS,6aS,8S,9aS,9bS,11R)-7-(Carboxymethyl)-11-fluoro-9-hydroxy-4a,6a,8-trimethyl-2-oxo-2,4a,5a,6,6a,7,8,9,9a,9b,10,11-dodecahydrocyclopenta[7,8]phenanthro[4b,5-b]oxiren-7-yl]-3-hydroxy-4-oxobutanoic acid
| Molecular Formula | C26H31FO9 |
|---|---|
| Molecular Weight | 506.20 g/mol |
| LogP | 1.4562 |
| Topological Polar Surface Area | 161.73 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 506.19522 |
| Heavy Atoms | 36 |
| Complexity | 1130.4487 |
Chemical Identifiers
| CAS Number | 60864-53-1 |
|---|---|
| SMILES | C[C@@H]1C([C@H]2[C@@H]3C[C@H](C4=CC(=O)C=C[C@@]4(C35C(O5)C[C@@]2(C1(CC(=O)O)C(=O)C(CC(=O)O)O)C)C)F)O |
Product Overview
C26H31FO7 (CAS 60864-53-1), with molecular formula C26H31FO9 and molecular weight 506.20 g/mol. IUPAC: 4-[(2S,8R,10S,11S,13S,15S)-14-(carboxymethyl)-8-fluoro-12-hydroxy-2,13,15-trimethyl-5-oxo-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadeca-3,6-dien-14-yl]-3-hydroxy-4-oxobutanoic acid.
Chemical Property Profile of C26H31FO7
Property Insights of C26H31FO7
The XLogP value of 1.4562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C26H31FO7. The TPSA of 161.73 Ų indicates high polarity, suggesting C26H31FO7 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C26H31FO7 has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C26H31FO7?
The CAS number of C26H31FO7 is 60864-53-1.
What is the molecular formula of C26H31FO7?
The molecular formula of C26H31FO7 is C26H31FO9.
What is the molecular weight of C26H31FO7?
The molecular weight of C26H31FO7 is 506.20 g/mol.
Where can I buy C26H31FO7?
You can request a quote for C26H31FO7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C26H31FO7?
Yes, KEHONG BIO provides custom synthesis services for C26H31FO7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.