4-(dimethylamino)-N-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-2-[(1R,2R,3R,5S)-5-(hydroxymethyl)-2,3,5-tris(oxidanyl)cyclohexyl]oxy-4,5-bis(oxidanyl)oxan-3-yl]benzamide

Systemtic Name: 4-(dimethylamino)-N-[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-2-[(1R,2R,3R,5S)-5-(hydroxymethyl)-2,3,5-tris(oxidanyl)cyclohexyl]oxy-4,5-bis(oxidanyl)oxan-3-yl]benzamide Openeye Name: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(1R,2R,3R,5S)-2,3,5-trihydroxy-5-(hydroxymethyl)cyclohexoxy]tetrahydropyran-3-yl]-4-(dimethylamino)benzamide CAS Name: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(1R,2R,3R,5S)-2,3,5-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxy-3-oxanyl]-4-(dimethylamino)benzamide IUPAC Name: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(1R,2R,3R,5S)-2,3,5-trihydroxy-5-(hydroxymethyl)cyclohexyl]oxyoxan-3-yl]-4-(dimethylamino)benzamide Traditional Name: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-methylol-2-[(1R,2R,3R,5S)-2,3,5-trihydroxy-5-methylol-cyclohexoxy]tetrahydropyran-3-yl]-4-(dimethylamino)benzamide Formula: C22H34N2O10 MolecularWeight: 486.51276

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)NC2C(C(C(OC2OC3CC(CC(C3O)O)(CO)O)CO)O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N[C@@H]2[C@H]([C@@H]([C@H](O[C@@H]2O[C@@H]3C[C@@](C[C@H]([C@H]3O)O)(CO)O)CO)O)O

InChI

InChI=1S/C22H34N2O10/c1-24(2)12-5-3-11(4-6-12)20(31)23-16-19(30)18(29)15(9-25)34-21(16)33-14-8-22(32,10-26)7-13(27)17(14)28/h3-6,13-19,21,25-30,32H,7-10H2,1-2H3,(H,23,31)/t13-,14-,15-,16-,17-,18-,19-,21+,22+/m1/s1