Elsamicin

Base Information

• Chemical Name: Elsamicin
• CAS No.: 97068-30-9
• Molecular Formula: C33H35 N O13
• Molecular Weight: 653.63
• NSC Number: 369327
• DSSTox Substance ID: DTXSID70869287
• ChEMBL ID: CHEMBL1974153
• Mol file: 97068-30-9.mol

Synonyms:BBM 2478A;BBM-2478A;BMY 28090;BMY-28090;elsamicin A;elsamitrucin

Chemical Property of Elsamicin

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 913.2°Cat760mmHg
• Flash Point: 506.1°C
• PSA: 213.51000
• Density: 1.57g/cm³
• LogP: 2.42660
• XLogP3: 2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 5
• Exact Mass: 653.21084017
• Heavy Atom Count: 47
• Complexity: 1210

Purity/Quality:

98% ^*data from raw suppliers

ELSAMITRUCIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2C(OC(C(C2(C)O)O)C)OC3=CC=CC4=C3C5=C6C7=C(C=CC(=C7C(=O)O5)C)OC(=O)C6=C4O)N)OC)O
• Uses: Antineoplastic.

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