O1-(1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl) O4-[2,2,2-tris(chloranyl)ethyl] 2-[2-[2-[2-[2-[2-[2-[[2-[2-[2-(2-acetamido-3-methyl-butanoyl)oxypropanoylamino]-3-methyl-butanoyl]oxy-3-methyl-butanoyl]amino]-3-methyl-butanoyl]oxypropanoylamino]-3-methyl-butanoyl]oxypropanoylamino]-3-methyl-butanoyl]oxypropanoylamino]butanedioate

Systemtic Name: O1-(1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl) O4-[2,2,2-tris(chloranyl)ethyl] 2-[2-[2-[2-[2-[2-[2-[[2-[2-[2-(2-acetamido-3-methyl-butanoyl)oxypropanoylamino]-3-methyl-butanoyl]oxy-3-methyl-butanoyl]amino]-3-methyl-butanoyl]oxypropanoylamino]-3-methyl-butanoyl]oxypropanoylamino]-3-methyl-butanoyl]oxypropanoylamino]butanedioate Openeye Name: O1-(1-methoxycarbonyl-2-methyl-propyl) O4-(2,2,2-trichloroethyl) 2-[2-[2-[2-[2-[2-[2-[[2-[2-[2-(2-acetamido-3-methyl-butanoyl)oxypropanoylamino]-3-methyl-butanoyl]oxy-3-methyl-butanoyl]amino]-3-methyl-butanoyl]oxypropanoylamino]-3-methyl-butanoyl]oxypropanoylamino]-3-methyl-butanoyl]oxypropanoylamino]butanedioate CAS Name: 2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-(2-acetamido-3-methyl-1-oxobutoxy)-1-oxopropyl]amino]-3-methyl-1-oxobutoxy]-3-methyl-1-oxobutyl]amino]-3-methyl-1-oxobutoxy]-1-oxopropyl]amino]-3-methyl-1-oxobutoxy]-1-oxopropyl]amino]-3-methyl-1-oxobutoxy]-1-oxopropyl]amino]butanedioic acid O1-(1-methoxy-3-methyl-1-oxobutan-2-yl) ester O4-(2,2,2-trichloroethyl) ester IUPAC Name: 1-O-(1-methoxy-3-methyl-1-oxobutan-2-yl) 4-O-(2,2,2-trichloroethyl) 2-[2-[2-[2-[2-[2-[2-[[2-[2-[2-(2-acetamido-3-methylbutanoyl)oxypropanoylamino]-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoyl]oxypropanoylamino]-3-methylbutanoyl]oxypropanoylamino]butanedioate Traditional Name: 2-[2-[2-[2-[2-[2-[2-[[2-[2-[2-(2-acetamido-3-methyl-butanoyl)oxypropanoylamino]-3-methyl-butanoyl]oxy-3-methyl-butanoyl]amino]-3-methyl-butanoyl]oxypropanoylamino]-3-methyl-butanoyl]oxypropanoylamino]-3-methyl-butanoyl]oxypropanoylamino]succinic acid O1-(1-carbomethoxy-2-methyl-propyl) ester O4-(2,2,2-trichloroethyl) ester Formula: C56H89Cl3N6O22 MolecularWeight: 1304.69186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C(=O)NC(C(C)C)C(=O)OC(C(C)C)C(=O)NC(C(C)C)C(=O)OC(C)C(=O)NC(C(C)C)C(=O)OC(C)C(=O)NC(C(C)C)C(=O)OC(C)C(=O)NC(CC(=O)OCC(Cl)(Cl)Cl)C(=O)OC(C(C)C)C(=O)OC)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)OC(C)C(=O)NC(C(C)C)C(=O)OC(C(C)C)C(=O)NC(C(C)C)C(=O)OC(C)C(=O)NC(C(C)C)C(=O)OC(C)C(=O)NC(C(C)C)C(=O)OC(C)C(=O)NC(CC(=O)OCC(Cl)(Cl)Cl)C(=O)OC(C(C)C)C(=O)OC)NC(=O)C

InChI

InChI=1S/C56H89Cl3N6O22/c1-23(2)37(60-34(19)66)50(74)83-31(16)47(71)64-41(27(9)10)54(78)86-42(28(11)12)48(72)65-40(26(7)8)53(77)85-33(18)46(70)63-39(25(5)6)52(76)84-32(17)45(69)62-38(24(3)4)51(75)82-30(15)44(68)61-35(21-36(67)81-22-56(57,58)59)49(73)87-43(29(13)14)55(79)80-20/h23-33,35,37-43H,21-22H2,1-20H3,(H,60,66)(H,61,68)(H,62,69)(H,63,70)(H,64,71)(H,65,72)