2-azanyl-3-[(2-azanyl-2-carboxy-4-oxidanyl-4-oxidanylidene-butyl)disulfanyl]-3-(carboxymethyl)butane-1,2,4-tricarboxylic acid

Systemtic Name: 2-azanyl-3-[(2-azanyl-2-carboxy-4-oxidanyl-4-oxidanylidene-butyl)disulfanyl]-3-(carboxymethyl)butane-1,2,4-tricarboxylic acid Openeye Name: 2-amino-3-[(2-amino-2-carboxy-4-hydroxy-4-oxo-butyl)disulfanyl]-3-(carboxymethyl)butane-1,2,4-tricarboxylic acid CAS Name: 2-amino-3-[(2-amino-2-carboxy-4-hydroxy-4-oxobutyl)disulfanyl]-3-(carboxymethyl)butane-1,2,4-tricarboxylic acid IUPAC Name: 2-amino-3-[(2-amino-2-carboxy-4-hydroxy-4-oxobutyl)disulfanyl]-3-(carboxymethyl)butane-1,2,4-tricarboxylic acid Traditional Name: 2-amino-3-[(2-amino-2-carboxy-4-hydroxy-4-keto-butyl)disulfanyl]-3-(carboxymethyl)butane-1,2,4-tricarboxylic acid Formula: C14H20N2O12S2 MolecularWeight: 472.4448

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)C(CC(=O)O)(C(CC(=O)O)(C(=O)O)N)SSCC(CC(=O)O)(C(=O)O)N

Isomeric SMILES

C(C(=O)O)C(CC(=O)O)(C(CC(=O)O)(C(=O)O)N)SSCC(CC(=O)O)(C(=O)O)N

InChI

InChI=1S/C14H20N2O12S2/c15-12(10(25)26,1-6(17)18)5-29-30-13(2-7(19)20,3-8(21)22)14(16,11(27)28)4-9(23)24/h1-5,15-16H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)(H,25,26)(H,27,28)