Leucomycin A6

Base Information

• Chemical Name: Leucomycin A6
• CAS No.: 18361-48-3
• Molecular Formula: C40H65 N O15
• Molecular Weight: 800.06
• UNII: 5FN79UZP05
• ChEMBL ID: CHEMBL3251854
• DSSTox Substance ID: DTXSID20860188
• Metabolomics Workbench ID: 70925,115570
• Wikidata: Q27116283
• Mol file: 18361-48-3.mol

Synonyms:leucomycin A6

Chemical Property of Leucomycin A6

Chemical Property:

• Vapor Pressure: 4.52E-35mmHg at 25°C
• Melting Point: 136.5°C
• Refractive Index: 1.6220 (estimate)
• Boiling Point: 867°Cat760mmHg
• Flash Point: 478.1°C
• PSA: 171.91000
• Density: 1.22g/cm³
• LogP: 1.82280
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 13
• Exact Mass: 799.43542037
• Heavy Atom Count: 56
• Complexity: 1340

Purity/Quality:

99% ^*data from raw suppliers

LEUCOMYCIN A6 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=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: CCC(=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