Chimeramycin B
TL;DR: Chimeramycin B (CAS 87092-83-9) is a chemical compound with molecular formula C45H78N2O13 and molecular weight 854.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,5S,6R,7S,9R,11E,13E,15S,16R)-6-[(2R,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-5,9,13,15-tetramethyl-2-oxo-1-oxacyclohexadeca-11,13-diene-7-carbaldehyde
Also Known As: Chimeramycin B, Tylosin, 23-de((6-deoxy-2,3-di-O-methyl-beta-D-allopyranosyl)oxy)-9-deoxo-9-((5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yl)oxy)-, (9R(2R,5S,6R))-, (4R,5S,6R,7S,9R,11E,13E,15S,16R)-6-((2R,3R,4R,5S,6R)-5-((2S,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl)oxy-10-((2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl)oxy-16-ethyl-4-hydroxy-5,9,13,15-tetramethyl-2-oxo-1-oxacyclohexadeca-11,13-diene-7-carbaldehyde, (4R,5S,6R,7S,9R,11E,13E,15S,16R)-6-[(2R,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-5,9,13,15-tetramethyl-2-oxo-1-oxacyclohexadeca-11,13-diene-7-carbaldehyde
| Molecular Formula | C45H78N2O13 |
|---|---|
| Molecular Weight | 854.55 g/mol |
| LogP | 3.5823 |
| Topological Polar Surface Area | 186.15 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 854.5504 |
| Heavy Atoms | 60 |
| Complexity | 1426.8658 |
Chemical Identifiers
| CAS Number | 87092-83-9 |
|---|---|
| SMILES | CC[C@@H]1[C@H](/C=C(/C=C/C([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)C)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)O)(C)O)N(C)C)O)C=O)C)O[C@H]4CC[C@@H]([C@H](O4)C)N(C)C)\C)C |
Product Overview
Chimeramycin B (CAS 87092-83-9), with molecular formula C45H78N2O13 and molecular weight 854.55 g/mol. IUPAC: (4R,5S,6R,7S,9R,11E,13E,15S,16R)-6-[(2R,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-5,9,13,15-tetramethyl-2-oxo-1-oxacyclohexadeca-11,13-diene-7-carbaldehyde.
Chemical Property Profile of Chimeramycin B
Property Insights of Chimeramycin B
The XLogP value of 3.5823 indicates that Chimeramycin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 186.15 Ų indicates high polarity, suggesting Chimeramycin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chimeramycin B has 4 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chimeramycin B?
The CAS number of Chimeramycin B is 87092-83-9.
What is the molecular formula of Chimeramycin B?
The molecular formula of Chimeramycin B is C45H78N2O13.
What is the molecular weight of Chimeramycin B?
The molecular weight of Chimeramycin B is 854.55 g/mol.
Where can I buy Chimeramycin B?
You can request a quote for Chimeramycin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chimeramycin B?
Yes, KEHONG BIO provides custom synthesis services for Chimeramycin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.