15-Dihydro-13,14-anhydrovirginiamycin M1

Base Information

• Chemical Name: 15-Dihydro-13,14-anhydrovirginiamycin M1
• CAS No.: 118693-64-4
• Molecular Formula: C28H35 N3 O6
• Molecular Weight: 509.594
• Wikidata: Q105032699
• Mol file: 118693-64-4.mol

Synonyms:15-dihydro-13,14-anhydrovirginiamycin M1;L 156586;L-156,586

Chemical Property of 15-Dihydro-13,14-anhydrovirginiamycin M1

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 767.1°Cat760mmHg
• Flash Point: 417.7°C
• PSA: 121.02000
• Density: 1.29g/cm³
• LogP: 1.22890
• XLogP3: 2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 509.25258584
• Heavy Atom Count: 37
• Complexity: 1120

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC(CC2N3C(CO2)C(C34CCC=C4C(=O)OC(C(=C)C=CC(=O)N=CN=C1)C(C)C)O)O
• Isomeric SMILES: C/C/1=C/C=C/[C@@H](CC2N3C(CO2)C(C34CCC=C4C(=O)O[C@H](C(=C)/C=C/C(=O)N=CN=C1)C(C)C)O)O