methyl 1-[3-[1-[1-[2-[[2-[[2-(dimethylamino)-3-methyl-butanoyl]amino]-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]carbonyloxy-4-methyl-pentanoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[3-[1-[1-[2-[[2-[[2-(dimethylamino)-3-methyl-butanoyl]amino]-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]carbonyloxy-4-methyl-pentanoyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[3-[1-[1-[2-[[2-[[2-(dimethylamino)-3-methyl-butanoyl]amino]-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]oxy-4-methyl-pentanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[3-[[1-[[1-[2-[[2-[[2-(dimethylamino)-3-methyl-1-oxobutyl]amino]-3-methyl-1-oxobutyl]-methylamino]-3-methyl-1-oxobutyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinyl]-oxomethoxy]-4-methyl-1-oxopentyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-[1-[1-[2-[[2-[[2-(dimethylamino)-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]oxy-4-methylpentanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[3-[1-[1-[2-[[2-[[2-(dimethylamino)-3-methyl-butanoyl]amino]-3-methyl-butanoyl]-methyl-amino]-3-methyl-butanoyl]prolyl]prolyl]oxy-4-methyl-pentanoyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C40H68N6O9 MolecularWeight: 777.00272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)N1CCCC1C(=O)OC)OC(=O)C2CCCN2C(=O)C3CCCN3C(=O)C(C(C)C)N(C)C(=O)C(C(C)C)NC(=O)C(C(C)C)N(C)C

Isomeric SMILES

CC(C)C(CC(=O)N1CCCC1C(=O)OC)OC(=O)C2CCCN2C(=O)C3CCCN3C(=O)C(C(C)C)N(C)C(=O)C(C(C)C)NC(=O)C(C(C)C)N(C)C

InChI

InChI=1S/C40H68N6O9/c1-23(2)30(22-31(47)44-19-14-17-28(44)39(52)54-12)55-40(53)29-18-15-21-46(29)36(49)27-16-13-20-45(27)38(51)34(26(7)8)43(11)37(50)32(24(3)4)41-35(48)33(25(5)6)42(9)10/h23-30,32-34H,13-22H2,1-12H3,(H,41,48)