[2-[2-[3-[[5-[[1-[[2-[4-[4-[[4-Amino-6-(4-Aminobutylamino)-6-Oxohexyl]Carbamoyl]-1,3-Thiazol-2-Yl]-1,3-Thiazol-2-Yl]-1-(5-Amino-3,4-Dihydroxy-6-Methyloxan-2-Yl)Oxy-2-Hydroxyethyl]Amino]-3-Hydroxy-1-Oxobutan-2-Yl]Amino]-3-Hydroxy-5-Oxopentan-2-Yl]Amino]-2-[[6-Amino-2-[3-Amino-1-[(2,3-Diamino-3-Oxopropyl)Amino]-3-Oxopropyl]-5-Methylpyrimidine-4-Carbonyl]Amino]-1-(3H-Imidazol-4-Yl)-3-Oxopropoxy]-4,5-Dihydroxy-6-(Hydroxymethyl)Oxan-3-Yl]Oxy-3,5-Dihydroxy-6-(Hydroxymethyl)Oxan-4-Yl] Carbamate
[CAS# 77368-68-4]

Identification

• Name: [2-[2-[3-[[5-[[1-[[2-[4-[4-[[4-Amino-6-(4-Aminobutylamino)-6-Oxohexyl]Carbamoyl]-1,3-Thiazol-2-Yl]-1,3-Thiazol-2-Yl]-1-(5-Amino-3,4-Dihydroxy-6-Methyloxan-2-Yl)Oxy-2-Hydroxyethyl]Amino]-3-Hydroxy-1-Oxobutan-2-Yl]Amino]-3-Hydroxy-5-Oxopentan-2-Yl]Amino]-2-[[6-Amino-2-[3-Amino-1-[(2,3-Diamino-3-Oxopropyl)Amino]-3-Oxopropyl]-5-Methylpyrimidine-4-Carbonyl]Amino]-1-(3H-Imidazol-4-Yl)-3-Oxopropoxy]-4,5-Dihydroxy-6-(Hydroxymethyl)Oxan-3-Yl]Oxy-3,5-Dihydroxy-6-(Hydroxymethyl)Oxan-4-Yl] Carbamate
• Synonyms: [2-[2-[3-[[5-[[1-[[2-[4-[4-[[4-Amino-6-(4-Aminobutylamino)-6-Oxo-Hexyl]Carbamoyl]-1,3-Thiazol-2-Yl]-1,3-Thiazol-2-Yl]-1-(5-Amino-3,4-Dihydroxy-6-Methyl-Oxan-2-Yl)Oxy-2-Hydroxy-Ethyl]Amino]-3-Hydroxy-1-Oxo-Butan-2-Yl]Amino]-3-Hydroxy-5-Oxo-Pentan-2-Yl]Amino]-2-[[6-Amino-2-[3-Amino-1-[(2,3-Diamino-3-Oxo-Propyl)Amino]-3-Oxo-Propyl]-5-Methyl-Pyrimidin-4-Yl]Carbonylamino]-1-(3H-Imidazol-4-Yl)-3-Oxo-Propoxy]-4,5-Dihydroxy-6-(Hydroxymethyl)Oxan-3-Yl]Oxy-3,5-Dihydroxy-6-(Hydroxymethyl)Oxan-4-Yl] Carbamate; Bleomycinamide, N(Sup 1)-(4-Amino-5-((4-Aminobutyl)Carbamoyl)Pentyl)-13-((4-Amino-4,6-Dideoxy-Alpha-L-Talopyranosyl)Oxy)-19-Demethyl-12-Hydroxy-, Copper Complex; Tallysomycin S(Sub 10A) Copper Complex
• Molecular Formula: C₆₅H₁₀₃N₂₁O₂₇S₂
• Molecular Weight: 1674.77
• CAS Registry Number: 77368-68-4
• SMILES: C1=C(N=C(S1)C(C(NC(C(C(C)O)NC(CC(C(NC(C(C(C2=CN=C[NH]2)OC3C(C(C(C(O3)CO)O)O)OC4OC(C(C(C4O)OC(N)=O)O)CO)NC(C5=NC(=NC(=C5C)N)C(NCC(C(N)=O)N)CC(N)=O)=O)=O)C)O)=O)=O)OC6C(C(C(C(O6)C)N)O)O)O)C7=NC(=CS7)C(NCCCC(CC(NCCCCN)=O)N)=O
• InChI: 1S/C65H103N21O27S2/c1-22-39(83-54(85-52(22)71)28(13-35(69)91)77-15-27(68)53(72)101)56(103)84-41(49(29-16-74-21-78-29)110-64-51(45(97)42(94)33(17-87)109-64)111-63-47(99)50(112-65(73)106)43(95)34(18-88)108-63)58(105)79-23(2)32(90)14-37(93)82-40(24(3)89)57(104)86-59(113-62-46(98)44(96)38(70)25(4)107-62)48(100)61-81-31(20-115-61)60-80-30(19-114-60)55(102)76-11-7-8-26(67)12-36(92)75-10-6-5-9-66/h16,19-21,23-28,32-34,38,40-51,59,62-64,77,87-90,94-100H,5-15,17-18,66-68,70H2,1-4H3,(H2,69,91)(H2,72,101)(H2,73,106)(H,74,78)(H,75,92)(H,76,102)(H,79,105)(H,82,93)(H,84,103)(H,86,104)(H2,71,83,85)
• InChIKey: MHLLIVLFMRYXES-UHFFFAOYSA-N

Properties

• Density: 1.612g/cm³ (Cal.)