4'-epi-Adriamycin

Base Information

• Chemical Name: 4'-epi-Adriamycin
• CAS No.: 57819-80-4
• Molecular Formula: C27H30ClNO11
• Molecular Weight: 579.9802
• European Community (EC) Number: 260-145-2
• DSSTox Substance ID: DTXSID10973397
• ChEMBL ID: CHEMBL4303456
• Mol file: 57819-80-4.mol

Synonyms:4' Epi Adriamycin;4' Epi Doxorubicin;4' Epi DXR;4' Epiadriamycin;4' Epidoxorubicin;4'-Epi-Adriamycin;4'-Epi-Doxorubicin;4'-Epi-DXR;4'-Epiadriamycin;4'-Epidoxorubicin;Ellence;EPI cell;EPI-cell;EPIcell;Epilem;Epirubicin;Epirubicin Hydrochloride;Farmorubicin;Farmorubicina;Farmorubicine;Hydrochloride, Epirubicin;IMI 28;IMI-28;IMI28;NSC 256942;NSC-256942;NSC256942;Pharmorubicin

Chemical Property of 4'-epi-Adriamycin

Chemical Property:

• Vapor Pressure: 9.64E-28mmHg at 25°C
• Boiling Point: 810.3°C at 760 mmHg
• Flash Point: 443.8°C
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 5
• Exact Mass: 579.1507385
• Heavy Atom Count: 40
• Complexity: 977

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.Cl
• Isomeric SMILES: C[C@H]1[C@@H]([C@H](C[C@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.Cl