N-[(2S,3S,4R,5S,6R)-6-(hydroxymethyl)-2-[(2S,3S,4S,5S,6R)-6-(methoxymethyl)-2-[[(2R,3S,4S,5R,6S)-6-(4-nitrophenoxy)-3,4,5-tris(oxidanyl)oxan-2-yl]methoxy]-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]ethanamide

Systemtic Name: N-[(2S,3S,4R,5S,6R)-6-(hydroxymethyl)-2-[(2S,3S,4S,5S,6R)-6-(methoxymethyl)-2-[[(2R,3S,4S,5R,6S)-6-(4-nitrophenoxy)-3,4,5-tris(oxidanyl)oxan-2-yl]methoxy]-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]ethanamide Openeye Name: N-[(2S,3S,4R,5S,6R)-2-[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(methoxymethyl)-2-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methoxy]tetrahydropyran-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide CAS Name: N-[(2S,3S,4R,5S,6R)-2-[[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(methoxymethyl)-2-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-nitrophenoxy)-2-oxanyl]methoxy]-3-oxanyl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)-3-oxanyl]acetamide IUPAC Name: N-[(2S,3S,4R,5S,6R)-2-[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(methoxymethyl)-2-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-nitrophenoxy)oxan-2-yl]methoxy]oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide Traditional Name: N-[(2S,3S,4R,5S,6R)-2-[(2S,3S,4S,5S,6R)-4,5-dihydroxy-6-(methoxymethyl)-2-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-nitrophenoxy)tetrahydropyran-2-yl]methoxy]tetrahydropyran-3-yl]oxy-4,5-dihydroxy-6-methylol-tetrahydropyran-3-yl]acetamide Formula: C27H40N2O18 MolecularWeight: 680.6091

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OC2C(C(C(OC2OCC3C(C(C(C(O3)OC4=CC=C(C=C4)[N+](=O)[O-])O)O)O)COC)O)O)CO)O)O

Isomeric SMILES

CC(=O)N[C@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@H]2[C@H]([C@@H]([C@H](O[C@@H]2OC[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)OC4=CC=C(C=C4)[N+](=O)[O-])O)O)O)COC)O)O)CO)O)O

InChI

InChI=1S/C27H40N2O18/c1-10(31)28-16-20(35)17(32)13(7-30)44-25(16)47-24-22(37)19(34)14(8-41-2)46-27(24)42-9-15-18(33)21(36)23(38)26(45-15)43-12-5-3-11(4-6-12)29(39)40/h3-6,13-27,30,32-38H,7-9H2,1-2H3,(H,28,31)/t13-,14-,15-,16+,17-,18-,19-,20-,21+,22+,23-,24+,25+,26-,27+/m1/s1