2-[2-[carboxymethyl-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]amino]ethyl-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]amino]ethanoic acid

Systemtic Name: 2-[2-[carboxymethyl-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]amino]ethyl-[[5-(hydroxymethyl)-2-methyl-3-oxidanyl-pyridin-4-yl]methyl]amino]ethanoic acid Openeye Name: 2-[2-[carboxymethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methyl]amino]ethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridyl]methyl]amino]acetic acid CAS Name: 2-[2-[carboxymethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methyl]amino]ethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methyl]amino]acetic acid IUPAC Name: 2-[2-[carboxymethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyl]amino]ethyl-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methyl]amino]acetic acid Traditional Name: 2-[2-[carboxymethyl-[(3-hydroxy-2-methyl-5-methylol-4-pyridyl)methyl]amino]ethyl-[(3-hydroxy-2-methyl-5-methylol-4-pyridyl)methyl]amino]acetic acid Formula: C22H30N4O8 MolecularWeight: 478.4956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CN(CCN(CC2=C(C(=NC=C2CO)C)O)CC(=O)O)CC(=O)O)CO

Isomeric SMILES

CC1=NC=C(C(=C1O)CN(CCN(CC2=C(C(=NC=C2CO)C)O)CC(=O)O)CC(=O)O)CO

InChI

InChI=1S/C22H30N4O8/c1-13-21(33)17(15(11-27)5-23-13)7-25(9-19(29)30)3-4-26(10-20(31)32)8-18-16(12-28)6-24-14(2)22(18)34/h5-6,27-28,33-34H,3-4,7-12H2,1-2H3,(H,29,30)(H,31,32)