Josamycin tartrate
TL;DR: Josamycin tartrate (CAS 52454-74-7) is a chemical compound with molecular formula C46H75NO21 and molecular weight 977.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-4-acetyloxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate;(2R,3R)-2,3-dihydroxybutanedioic acid
Also Known As: Josamycin tartrate, Leucomycin A3 tartrate, TURIMYCIN A5 TARTRATE, KITASAMYCIN A3 TARTRATE, Leucomycin V, 3-acetate 4(sup B)-(3-methylbutanoate), (R-(R*,R*))-2,3-dihydroxybutanedioate(salt)
| Molecular Formula | C46H75NO21 |
|---|---|
| Molecular Weight | 977.48 g/mol |
| LogP | 0.8908 |
| Topological Polar Surface Area | 321.11 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 15 |
| Exact Mass | 977.48315 |
| Heavy Atoms | 68 |
| Complexity | 1669.2787 |
Chemical Identifiers
| CAS Number | 52454-74-7 |
|---|---|
| SMILES | C[C@@H]1C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)OC(=O)C)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)CC(C)C)(C)O)N(C)C)O)CC=O)C)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
Product Overview
Josamycin tartrate (CAS 52454-74-7), with molecular formula C46H75NO21 and molecular weight 977.48 g/mol. IUPAC: [(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-4-acetyloxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate;(2R,3R)-2,3-dihydroxybutanedioic acid.
Chemical Property Profile of Josamycin tartrate
Property Insights of Josamycin tartrate
The XLogP value of 0.8908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Josamycin tartrate. The TPSA of 321.11 Ų indicates high polarity, suggesting Josamycin tartrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Josamycin tartrate has 7 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Josamycin tartrate?
The CAS number of Josamycin tartrate is 52454-74-7.
What is the molecular formula of Josamycin tartrate?
The molecular formula of Josamycin tartrate is C46H75NO21.
What is the molecular weight of Josamycin tartrate?
The molecular weight of Josamycin tartrate is 977.48 g/mol.
Where can I buy Josamycin tartrate?
You can request a quote for Josamycin tartrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Josamycin tartrate?
Yes, KEHONG BIO provides custom synthesis services for Josamycin tartrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.