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

Systemtic Name: 5-acetamido-4-oxidanyl-2-(1-oxidanyloctyl)-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid Openeye Name: 5-acetamido-4-hydroxy-2-(1-hydroxyoctyl)-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid CAS Name: 5-acetamido-4-hydroxy-2-(1-hydroxyoctyl)-6-(1,2,3-trihydroxypropyl)-2-oxanecarboxylic acid IUPAC Name: 5-acetamido-4-hydroxy-2-(1-hydroxyoctyl)-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid Traditional Name: 5-acetamido-4-hydroxy-2-(1-hydroxyoctyl)-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid Formula: C19H35NO9 MolecularWeight: 421.4825

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C1(CC(C(C(O1)C(C(CO)O)O)NC(=O)C)O)C(=O)O)O

Isomeric SMILES

CCCCCCCC(C1(CC(C(C(O1)C(C(CO)O)O)NC(=O)C)O)C(=O)O)O

InChI

InChI=1S/C19H35NO9/c1-3-4-5-6-7-8-14(25)19(18(27)28)9-12(23)15(20-11(2)22)17(29-19)16(26)13(24)10-21/h12-17,21,23-26H,3-10H2,1-2H3,(H,20,22)(H,27,28)