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

Systemtic Name: 5-azanyl-2-[[2-[[2-[[2-[2-[[2-[[2-[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]propanoylamino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[2-[[2-[[2-[2-[[2-[[2-[2-[(2-amino-3-hydroxy-butanoyl)amino]propanoylamino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoyl]amino]-5-hydroxy-5-oxo-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-3-hydroxy-1-oxobutyl)amino]-1-oxopropyl]amino]-3-methyl-1-oxobutyl]amino]-3-methyl-1-oxobutyl]amino]-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-5-hydroxy-1,5-dioxopentyl]amino]-4-methyl-1-oxopentyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[2-[[2-[[2-[2-[[2-[[2-[2-[(2-amino-3-hydroxybutanoyl)amino]propanoylamino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]propanoylamino]-4-methylpentanoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[[2-[[2-[[2-[2-[[2-[[2-[2-[(2-amino-3-hydroxy-butanoyl)amino]propanoylamino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoyl]amino]-5-hydroxy-5-keto-pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-keto-valeric acid Formula: C42H74N10O14 MolecularWeight: 943.09556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C42H74N10O14/c1-18(2)16-27(37(60)47-25(13-15-30(55)56)36(59)50-28(17-19(3)4)38(61)48-26(42(65)66)12-14-29(43)54)49-34(57)22(9)46-40(63)32(20(5)6)52-41(64)33(21(7)8)51-35(58)23(10)45-39(62)31(44)24(11)53/h18-28,31-33,53H,12-17,44H2,1-11H3,(H2,43,54)(H,45,62)(H,46,63)(H,47,60)(H,48,61)(H,49,57)(H,50,59)(H,51,58)(H,52,64)(H,55,56)(H,65,66)