N1-[3-(Dimethylsulfonio)Propyl]-Bleomycinamide Chloride
[CAS# 49830-49-1]

Identification

• Name: N1-[3-(Dimethylsulfonio)Propyl]-Bleomycinamide Chloride
• Synonyms: N(Sup1)-(3-(Dimethylsulfonio)Propyl)-Bleomycinamidchloride; BLEOMYCIN A2, HYDROCHLORIDE; Bleomycin A2-Hcl
• Molecular Formula: C₅₅H₈₄ClN₁₇O₂₁S₃
• Molecular Weight: 1451.00
• CAS Registry Number: 49830-49-1
• SMILES: OCC1OC(O[C@H]([C@@H](C(=O)N[C@@H]([C@H]([C@@H](C(=O)N[C@H](C(=O)NCCc2scc(n2)c2scc(n2)C(=O)NCCC[S+](C)C)[C@H](O)C)C)O)C)NC(=O)c2nc(nc(c2C)N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)c2nc[nH]c2)C(C(C1O)O)OC1OC(CO
• InChI: InChI=1S/C55H83N17O21S3.ClH/c1-20-33(69-46(72-44(20)58)25(12-31(57)76)64-13-24(56)45(59)82)50(86)71-35(41(26-14-61-19-65-26)91-54-43(39(80)37(78)29(15-73)90-54)92-53-40(81)42(93-55(60)88)38(79)30(16-7