2-[2-[[2-[[2-[[2-[[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-methyl-pentanoyl]amino]propanoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-[[2-[[2-[[2-[[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-methyl-pentanoyl]amino]propanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-butanoyl)amino]-4-methyl-pentanoyl]amino]-5-hydroxy-5-oxo-pentanoyl]amino]-4-hydroxy-4-oxo-butanoyl]amino]-3-methyl-pentanoyl]amino]propanoylamino]-3-methyl-pentanoic acid CAS Name: 2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-1-oxobutyl)amino]-4-methyl-1-oxopentyl]amino]-5-hydroxy-1,5-dioxopentyl]amino]-4-hydroxy-1,4-dioxobutyl]amino]-3-methyl-1-oxopentyl]amino]-1-oxopropyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxybutanoyl)amino]-4-methylpentanoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]-4-hydroxy-4-oxobutanoyl]amino]-3-methylpentanoyl]amino]propanoylamino]-3-methylpentanoic acid Traditional Name: 2-[2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-butanoyl)amino]-4-methyl-pentanoyl]amino]-5-hydroxy-5-keto-pentanoyl]amino]-4-hydroxy-4-keto-butanoyl]amino]-3-methyl-pentanoyl]amino]propanoylamino]-3-methyl-valeric acid Formula: C34H59N7O13 MolecularWeight: 773.87136

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C)C(=O)NC(C(C)CC)C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(C(C)O)N

Isomeric SMILES

CCC(C)C(C(=O)NC(C)C(=O)NC(C(C)CC)C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(C(C)O)N

InChI

InChI=1S/C34H59N7O13/c1-9-16(5)26(33(52)36-18(7)28(47)41-27(34(53)54)17(6)10-2)40-31(50)22(14-24(45)46)38-29(48)20(11-12-23(43)44)37-30(49)21(13-15(3)4)39-32(51)25(35)19(8)42/h15-22,25-27,42H,9-14,35H2,1-8H3,(H,36,52)(H,37,49)(H,38,48)(H,39,51)(H,40,50)(H,41,47)(H,43,44)(H,45,46)(H,53,54)