3-[[4,5-bis(azanyl)-3-carboxy-1-oxidanidyl-1-oxidanylidene-pentan-3-yl]-[1-[bis(carboxymethyl)amino]-4-oxidanidyl-4-oxidanylidene-butan-2-yl]amino]-3-carboxy-pentanedioate

Systemtic Name: 3-[[4,5-bis(azanyl)-3-carboxy-1-oxidanidyl-1-oxidanylidene-pentan-3-yl]-[1-[bis(carboxymethyl)amino]-4-oxidanidyl-4-oxidanylidene-butan-2-yl]amino]-3-carboxy-pentanedioate Openeye Name: 3-[[1-[[bis(carboxymethyl)amino]methyl]-3-oxido-3-oxo-propyl]-[2,3-diamino-1-carboxy-1-(2-oxido-2-oxo-ethyl)propyl]amino]-3-carboxy-pentanedioate CAS Name: 3-[[1-[bis(carboxymethyl)amino]-4-oxido-4-oxobutan-2-yl]-(4,5-diamino-3-carboxy-1-oxido-1-oxopentan-3-yl)amino]-3-carboxypentanedioate IUPAC Name: 3-[[1-[bis(carboxymethyl)amino]-4-oxido-4-oxobutan-2-yl]-(4,5-diamino-3-carboxy-1-oxido-1-oxopentan-3-yl)amino]-3-carboxypentanedioate Traditional Name: 3-[[1-[[bis(carboxymethyl)amino]methyl]-3-keto-3-oxido-propyl]-[2,3-diamino-1-carboxy-1-(2-keto-2-oxido-ethyl)propyl]amino]-3-carboxy-glutarate Formula: C20H26N4O16-4 MolecularWeight: 578.43764

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CN(CC(=O)O)CC(=O)O)N(C(CC(=O)[O-])(CC(=O)[O-])C(=O)O)C(CC(=O)[O-])(C(CN)N)C(=O)O)C(=O)[O-]

Isomeric SMILES

C(C(CN(CC(=O)O)CC(=O)O)N(C(CC(=O)[O-])(CC(=O)[O-])C(=O)O)C(CC(=O)[O-])(C(CN)N)C(=O)O)C(=O)[O-]

InChI

InChI=1S/C20H30N4O16/c21-5-10(22)20(18(39)40,4-14(31)32)24(19(17(37)38,2-12(27)28)3-13(29)30)9(1-11(25)26)6-23(7-15(33)34)8-16(35)36/h9-10H,1-8,21-22H2,(H,25,26)(H,27,28)(H,29,30)(H,31,32)(H,33,34)(H,35,36)(H,37,38)(H,39,40)/p-4