4-[[2-[[2-[[2-[[2-[[2-[2-(2-azanylpropanoylamino)propanoylamino]-3-methyl-butanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-oxidanyl-butanoyl]amino]-3-oxidanyl-propanoyl]amino]-3-oxidanyl-propanoyl]amino]-5-[[1-[[1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[[2-[[2-[[2-[[2-[[2-[2-(2-azanylpropanoylamino)propanoylamino]-3-methyl-butanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-oxidanyl-butanoyl]amino]-3-oxidanyl-propanoyl]amino]-3-oxidanyl-propanoyl]amino]-5-[[1-[[1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]amino]-3-methyl-1-oxidanylidene-pentan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[[2-[[2-[[2-[[2-[[2-[2-(2-aminopropanoylamino)propanoylamino]-3-methyl-butanoyl]amino]-4-hydroxy-4-oxo-butanoyl]amino]-3-hydroxy-butanoyl]amino]-3-hydroxy-propanoyl]amino]-3-hydroxy-propanoyl]amino]-5-[[1-[(1-carboxy-2-hydroxy-propyl)carbamoyl]-2-methyl-butyl]amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-3-methyl-1-oxobutyl]amino]-4-hydroxy-1,4-dioxobutyl]amino]-3-hydroxy-1-oxobutyl]amino]-3-hydroxy-1-oxopropyl]amino]-3-hydroxy-1-oxopropyl]amino]-5-[[1-[(1,3-dihydroxy-1-oxobutan-2-yl)amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-[[2-[[2-[[2-[[2-[[2-[2-(2-aminopropanoylamino)propanoylamino]-3-methylbutanoyl]amino]-4-hydroxy-4-oxobutanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoyl]amino]-5-[[1-[(1,3-dihydroxy-1-oxobutan-2-yl)amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-[[2-[[2-[[2-[[2-[[2-[2-(alanylamino)propanoylamino]-3-methyl-butanoyl]amino]-4-hydroxy-4-keto-butanoyl]amino]-3-hydroxy-butanoyl]amino]-3-hydroxy-propanoyl]amino]-3-hydroxy-propanoyl]amino]-5-[[1-[(1-carboxy-2-hydroxy-propyl)carbamoyl]-2-methyl-butyl]amino]-5-keto-valeric acid Formula: C40H68N10O19 MolecularWeight: 993.02352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H68N10O19/c1-9-16(4)28(38(66)50-30(20(8)54)40(68)69)48-33(61)21(10-11-25(55)56)43-35(63)23(13-51)45-36(64)24(14-52)46-39(67)29(19(7)53)49-34(62)22(12-26(57)58)44-37(65)27(15(2)3)47-32(60)18(6)42-31(59)17(5)41/h15-24,27-30,51-54H,9-14,41H2,1-8H3,(H,42,59)(H,43,63)(H,44,65)(H,45,64)(H,46,67)(H,47,60)(H,48,61)(H,49,62)(H,50,66)(H,55,56)(H,57,58)(H,68,69)