(2S,4S,5S,6R)-2-ethoxy-5-(hexadecanoylamino)-N,N-dimethyl-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxamide

Systemtic Name: (2S,4S,5S,6R)-2-ethoxy-5-(hexadecanoylamino)-N,N-dimethyl-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxamide Openeye Name: (2S,4S,5S,6R)-2-ethoxy-5-(hexadecanoylamino)-4-hydroxy-N,N-dimethyl-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxamide CAS Name: (2S,4S,5S,6R)-2-ethoxy-4-hydroxy-N,N-dimethyl-5-(1-oxohexadecylamino)-6-(1,2,3-trihydroxypropyl)-2-oxanecarboxamide IUPAC Name: (2S,4S,5S,6R)-2-ethoxy-5-(hexadecanoylamino)-4-hydroxy-N,N-dimethyl-6-(1,2,3-trihydroxypropyl)oxane-2-carboxamide Traditional Name: (2S,4S,5S,6R)-2-ethoxy-4-hydroxy-N,N-dimethyl-5-palmitamido-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxamide Formula: C29H56N2O8 MolecularWeight: 560.76354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)N(C)C)OCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[C@H]1[C@H](C[C@](O[C@H]1C(C(CO)O)O)(C(=O)N(C)C)OCC)O

InChI

InChI=1S/C29H56N2O8/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-24(35)30-25-22(33)20-29(38-6-2,28(37)31(3)4)39-27(25)26(36)23(34)21-32/h22-23,25-27,32-34,36H,5-21H2,1-4H3,(H,30,35)/t22-,23?,25-,26?,27+,29-/m0/s1