3-(2-methylpropanoylamino)-4-propoxy-2-[1,2,3-tris(oxidanyl)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: 3-(2-methylpropanoylamino)-4-propoxy-2-[1,2,3-tris(oxidanyl)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-(2-methylpropanoylamino)-4-propoxy-2-(1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-[(2-methyl-1-oxopropyl)amino]-4-propoxy-2-(1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-(2-methylpropanoylamino)-4-propoxy-2-(1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-(isobutyrylamino)-4-propoxy-2-(1,2,3-trihydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C16H27NO8 MolecularWeight: 361.38748

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1C=C(OC(C1NC(=O)C(C)C)C(C(CO)O)O)C(=O)O

Isomeric SMILES

CCCOC1C=C(OC(C1NC(=O)C(C)C)C(C(CO)O)O)C(=O)O

InChI

InChI=1S/C16H27NO8/c1-4-5-24-10-6-11(16(22)23)25-14(13(20)9(19)7-18)12(10)17-15(21)8(2)3/h6,8-10,12-14,18-20H,4-5,7H2,1-3H3,(H,17,21)(H,22,23)