methyl 4-azanyl-6-[[3-[5-[[4-[5-[[4-[5-[ethanoyl(oxidanidyl)amino]pentylamino]-4-oxidanylidene-butanoyl]-oxidanidyl-amino]pentylamino]-4-oxidanylidene-butanoyl]-oxidanidyl-amino]pentylcarbamoyl]-5-oxidanyl-phenyl]amino]-5-(hydroxymethyl)-6-methyl-5-oxidanyl-2-oxidanylidene-piperidine-3-carboximidate

Systemtic Name: methyl 4-azanyl-6-[[3-[5-[[4-[5-[[4-[5-[ethanoyl(oxidanidyl)amino]pentylamino]-4-oxidanylidene-butanoyl]-oxidanidyl-amino]pentylamino]-4-oxidanylidene-butanoyl]-oxidanidyl-amino]pentylcarbamoyl]-5-oxidanyl-phenyl]amino]-5-(hydroxymethyl)-6-methyl-5-oxidanyl-2-oxidanylidene-piperidine-3-carboximidate Openeye Name: methyl 6-[3-[5-[[4-[5-[[4-[5-[acetyl(oxido)amino]pentylamino]-4-oxo-butanoyl]-oxido-amino]pentylamino]-4-oxo-butanoyl]-oxido-amino]pentylcarbamoyl]-5-hydroxy-anilino]-4-amino-5-hydroxy-5-(hydroxymethyl)-6-methyl-2-oxo-piperidine-3-carboximidate CAS Name: 6-[3-[[5-[[4-[5-[[4-[5-[acetyl(oxido)amino]pentylamino]-1,4-dioxobutyl]-oxidoamino]pentylamino]-1,4-dioxobutyl]-oxidoamino]pentylamino]-oxomethyl]-5-hydroxyanilino]-4-amino-5-hydroxy-5-(hydroxymethyl)-6-methyl-2-oxo-3-piperidinecarboximidic acid methyl ester IUPAC Name: methyl 6-[3-[5-[[4-[5-[[4-[5-[acetyl(oxido)amino]pentylamino]-4-oxobutanoyl]-oxidoamino]pentylamino]-4-oxobutanoyl]-oxidoamino]pentylcarbamoyl]-5-hydroxyanilino]-4-amino-5-hydroxy-5-(hydroxymethyl)-6-methyl-2-oxopiperidine-3-carboximidate Traditional Name: 6-[3-[5-[[4-[5-[[4-[5-[acetyl(oxido)amino]pentylamino]-4-keto-butanoyl]-oxido-amino]pentylamino]-4-keto-butanoyl]-oxido-amino]pentylcarbamoyl]-5-hydroxy-anilino]-4-amino-5-hydroxy-2-keto-6-methyl-5-methylol-piperidine-3-carboximidic acid methyl ester Formula: C41H65N10O14-3 MolecularWeight: 922.0134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCCCNC(=O)CCC(=O)N(CCCCCNC(=O)CCC(=O)N(CCCCCNC(=O)C1=CC(=CC(=C1)O)NC2(C(C(C(C(=O)N2)C(=N)OC)N)(CO)O)C)[O-])[O-])[O-]

Isomeric SMILES

CC(=O)N(CCCCCNC(=O)CCC(=O)N(CCCCCNC(=O)CCC(=O)N(CCCCCNC(=O)C1=CC(=CC(=C1)O)NC2(C(C(C(C(=O)N2)C(=N)OC)N)(CO)O)C)[O-])[O-])[O-]

InChI

InChI=1S/C41H65N10O14/c1-27(53)49(62)20-10-4-7-17-44-31(55)13-15-33(57)50(63)21-11-5-8-18-45-32(56)14-16-34(58)51(64)22-12-6-9-19-46-38(59)28-23-29(25-30(54)24-28)47-40(2)41(61,26-52)36(42)35(37(43)65-3)39(60)48-40/h23-25,35-36,43,47,52,54,61H,4-22,26,42H2,1-3H3,(H,44,55)(H,45,56)(H,46,59)(H,48,60)/q-3