7-azanyl-5,6-bis(carboxymethyl)-3,4,5,6-tetrakis(oxidanyl)-8-oxidanylidene-decanedioic acid

Systemtic Name: 7-azanyl-5,6-bis(carboxymethyl)-3,4,5,6-tetrakis(oxidanyl)-8-oxidanylidene-decanedioic acid Openeye Name: 7-amino-5,6-bis(carboxymethyl)-3,4,5,6-tetrahydroxy-8-oxo-decanedioic acid CAS Name: 7-amino-5,6-bis(carboxymethyl)-3,4,5,6-tetrahydroxy-8-oxodecanedioic acid IUPAC Name: 7-amino-5,6-bis(carboxymethyl)-3,4,5,6-tetrahydroxy-8-oxodecanedioic acid Traditional Name: 7-amino-5,6-bis(carboxymethyl)-3,4,5,6-tetrahydroxy-8-keto-sebacic acid Formula: C14H21NO13 MolecularWeight: 411.31544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO13/c15-11(5(16)1-7(18)19)13(27,3-9(22)23)14(28,4-10(24)25)12(26)6(17)2-8(20)21/h6,11-12,17,26-28H,1-4,15H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)