4-[[2-(2-azanylpropanoylamino)-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-(2-azanylpropanoylamino)-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-(2-aminopropanoylamino)-3-methyl-pentanoyl]amino]-5-[[2-[(1-carboxy-4-guanidino-butyl)amino]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-[(2-amino-1-oxopropyl)amino]-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-(2-aminopropanoylamino)-3-methylpentanoyl]amino]-5-[[2-[[5-(diaminomethylideneamino)-1-hydroxy-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-5-oxopentanoic acid Traditional Name: 4-[[2-(alanylamino)-3-methyl-pentanoyl]amino]-5-[[2-[(1-carboxy-4-guanidino-butyl)amino]-2-keto-ethyl]amino]-5-keto-valeric acid Formula: C22H40N8O8 MolecularWeight: 544.6018

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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)C(C)N

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)C(C)N

InChI

InChI=1S/C22H40N8O8/c1-4-11(2)17(30-18(34)12(3)23)20(36)29-13(7-8-16(32)33)19(35)27-10-15(31)28-14(21(37)38)6-5-9-26-22(24)25/h11-14,17H,4-10,23H2,1-3H3,(H,27,35)(H,28,31)(H,29,36)(H,30,34)(H,32,33)(H,37,38)(H4,24,25,26)