(2R)-2-[(2R,3S,4R,5R,6R)-5-acetamido-2-(hydroxymethyl)-3-oxidanyl-6-phosphonooxy-oxan-4-yl]oxypropanoic acid; N,N-diethylethanamine

Systemtic Name: (2R)-2-[(2R,3S,4R,5R,6R)-5-acetamido-2-(hydroxymethyl)-3-oxidanyl-6-phosphonooxy-oxan-4-yl]oxypropanoic acid; N,N-diethylethanamine Openeye Name: (2R)-2-[(2R,3S,4R,5R,6R)-5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-phosphonooxy-tetrahydropyran-4-yl]oxypropanoic acid; N,N-diethylethanamine CAS Name: (2R)-2-[[(2R,3S,4R,5R,6R)-5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-phosphonooxy-4-oxanyl]oxy]propanoic acid; N,N-diethylethanamine IUPAC Name: (2R)-2-[(2R,3S,4R,5R,6R)-5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-phosphonooxyoxan-4-yl]oxypropanoic acid; N,N-diethylethanamine Traditional Name: (2R)-2-[(2R,3S,4R,5R,6R)-5-acetamido-3-hydroxy-2-methylol-6-phosphonooxy-tetrahydropyran-4-yl]oxypropionic acid; triethylamine Formula: C29H65N4O11P MolecularWeight: 676.820361

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CCN(CC)CC.CCN(CC)CC.CC(C(=O)O)OC1C(C(OC(C1O)CO)OP(=O)(O)O)NC(=O)C

Isomeric SMILES

CCN(CC)CC.CCN(CC)CC.CCN(CC)CC.C[C@H](C(=O)O)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)OP(=O)(O)O)NC(=O)C

InChI

InChI=1S/C11H20NO11P.3C6H15N/c1-4(10(16)17)21-9-7(12-5(2)14)11(23-24(18,19)20)22-6(3-13)8(9)15;3*1-4-7(5-2)6-3/h4,6-9,11,13,15H,3H2,1-2H3,(H,12,14)(H,16,17)(H2,18,19,20);3*4-6H2,1-3H3/t4-,6-,7-,8-,9-,11-;;;/m1.../s1