Leucomycin A4

Base Information

• Chemical Name: Leucomycin A4
• CAS No.: 18361-46-1
• Molecular Formula: C41H67NO15
• Molecular Weight: 813.9684
• UNII: BP88W7ZP3A
• ChEMBL ID: CHEMBL3251852
• Metabolomics Workbench ID: 98803
• Wikidata: Q27116281
• Mol file: 18361-46-1.mol

Synonyms:Leucomycin A4;Leukomycin A4;18361-46-1;BP88W7ZP3A;CHEBI:34814;[(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] butanoate;UNII-BP88W7ZP3A;BRN 1678667;KITASAMYCIN A4;Leucomycin V, 3-acetate 4(sup B)-butanoate;CHEMBL3251852;J-011763;Q27116281

Chemical Property of Leucomycin A4

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 874°Cat760mmHg
• PKA: 13.06±0.70(Predicted)
• Flash Point: 482.4°C
• PSA: 206.05000
• Density: 1.21g/cm³
• LogP: 2.76740
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 14
• Exact Mass: 813.45107043
• Heavy Atom Count: 57
• Complexity: 1360

Purity/Quality:

98% ^*data from raw suppliers

LeucomycinA4 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OC1C(OC(CC1(C)O)OC2C(OC(C(C2N(C)C)O)OC3C(CC(C(C=CC=CCC(OC(=O)CC(C3OC)OC(=O)C)C)O)C)CC=O)C)C
• Isomeric SMILES: CCCC(=O)O[C@H]1[C@@H](O[C@H](C[C@@]1(C)O)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2N(C)C)O)O[C@H]3[C@H](C[C@H]([C@H](/C=C/C=C/C[C@H](OC(=O)C[C@H]([C@@H]3OC)OC(=O)C)C)O)C)CC=O)C)C
• Uses: Leucomycin A4 is a major metabolite from the leucomycin complex, a family of closely related macrocyclic lactone antibiotics produced by Streptomyces kitasatoensis, discovered in 1953. Leucomycin A4 is one of the more potent antibiotics of the complex. Leucomycin complex (kitasamycin) is used as an animal health product for control of Gram positive bacteria, Gram negative cocci, leptospira and mycoplasma. Little is known about the activity of individual analogues within the complex as their limited availability has restricted investigation. Leucomycin A4 is a potent macrocyclic lactone antibiotic.