5-acetamido-2-(4-methanoyl-3-methoxy-phenoxy)-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid

Systemtic Name: 5-acetamido-2-(4-methanoyl-3-methoxy-phenoxy)-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid Openeye Name: 5-acetamido-2-(4-formyl-3-methoxy-phenoxy)-4-hydroxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid CAS Name: 5-acetamido-2-(4-formyl-3-methoxyphenoxy)-4-hydroxy-6-(1,2,3-trihydroxypropyl)-2-oxanecarboxylic acid IUPAC Name: 5-acetamido-2-(4-formyl-3-methoxyphenoxy)-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid Traditional Name: 5-acetamido-2-(4-formyl-3-methoxy-phenoxy)-4-hydroxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid Formula: C19H25NO11 MolecularWeight: 443.4019

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)OC2=CC(=C(C=C2)C=O)OC)O

Isomeric SMILES

CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)OC2=CC(=C(C=C2)C=O)OC)O

InChI

InChI=1S/C19H25NO11/c1-9(23)20-15-12(24)6-19(18(27)28,31-17(15)16(26)13(25)8-22)30-11-4-3-10(7-21)14(5-11)29-2/h3-5,7,12-13,15-17,22,24-26H,6,8H2,1-2H3,(H,20,23)(H,27,28)