4-[(2-benzamido-3-methyl-pentanoyl)amino]-5-[[2-[[5-[bis(azanyl)methylideneamino]-1-oxidanyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[(2-benzamido-3-methyl-pentanoyl)amino]-5-[[2-[[5-[bis(azanyl)methylideneamino]-1-oxidanyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[(2-benzamido-3-methyl-pentanoyl)amino]-5-[[2-[(1-carboxy-4-guanidino-butyl)amino]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-[(2-benzamido-3-methyl-1-oxopentyl)amino]-5-[[2-[[5-(diaminomethylideneamino)-1-hydroxy-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 4-[(2-benzamido-3-methylpentanoyl)amino]-5-[[2-[[5-(diaminomethylideneamino)-1-hydroxy-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-5-oxopentanoic acid Traditional Name: 4-[(2-benzamido-3-methyl-pentanoyl)amino]-5-[[2-[(1-carboxy-4-guanidino-butyl)amino]-2-keto-ethyl]amino]-5-keto-valeric acid Formula: C26H39N7O8 MolecularWeight: 577.62996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCC(=O)O)C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CCC(C)C(C(=O)NC(CCC(=O)O)C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C26H39N7O8/c1-3-15(2)21(33-22(37)16-8-5-4-6-9-16)24(39)32-17(11-12-20(35)36)23(38)30-14-19(34)31-18(25(40)41)10-7-13-29-26(27)28/h4-6,8-9,15,17-18,21H,3,7,10-14H2,1-2H3,(H,30,38)(H,31,34)(H,32,39)(H,33,37)(H,35,36)(H,40,41)(H4,27,28,29)