2-[[2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]oxyamino]propanoic acid; 2-azanyl-3-methyl-butanoic acid; 2-azanyl-3-methyl-pentanoic acid; 2-azanyl-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]oxyamino]propanoic acid; 2-azanyl-3-methyl-butanoic acid; 2-azanyl-3-methyl-pentanoic acid; 2-azanyl-4-methyl-pentanoic acid Openeye Name: 2-[(2-amino-5-guanidino-pentanoyl)oxyamino]propanoic acid; 2-amino-3-methyl-butanoic acid; 2-amino-3-methyl-pentanoic acid; 2-amino-4-methyl-pentanoic acid CAS Name: 2-[[2-amino-5-(diaminomethylideneamino)-1-oxopentoxy]amino]propanoic acid; 2-amino-3-methylbutanoic acid; 2-amino-3-methylpentanoic acid; 2-amino-4-methylpentanoic acid IUPAC Name: 2-[[2-amino-5-(diaminomethylideneamino)pentanoyl]oxyamino]propanoic acid; 2-amino-3-methylbutanoic acid; 2-amino-3-methylpentanoic acid; 2-amino-4-methylpentanoic acid Traditional Name: 2-[(2-amino-5-guanidino-pentanoyl)oxyamino]propionic acid; 2-amino-3-methyl-butyric acid; 2-amino-3-methyl-valeric acid; 2-amino-4-methyl-valeric acid Formula: C26H56N8O10 MolecularWeight: 640.77044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)N.CC(C)CC(C(=O)O)N.CC(C)C(C(=O)O)N.CC(C(=O)O)NOC(=O)C(CCCN=C(N)N)N

Isomeric SMILES

CCC(C)C(C(=O)O)N.CC(C)CC(C(=O)O)N.CC(C)C(C(=O)O)N.CC(C(=O)O)NOC(=O)C(CCCN=C(N)N)N

InChI

InChI=1S/C9H19N5O4.2C6H13NO2.C5H11NO2/c1-5(7(15)16)14-18-8(17)6(10)3-2-4-13-9(11)12;1-4(2)3-5(7)6(8)9;1-3-4(2)5(7)6(8)9;1-3(2)4(6)5(7)8/h5-6,14H,2-4,10H2,1H3,(H,15,16)(H4,11,12,13);2*4-5H,3,7H2,1-2H3,(H,8,9);3-4H,6H2,1-2H3,(H,7,8)