[(2R,3R,4S,5S,6S)-4,5-diacetyloxy-6-(1-methylpyrrol-3-yl)-3-[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5S,6S)-4,5-diacetyloxy-6-(1-methylpyrrol-3-yl)-3-[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5S,6S)-4,5-diacetoxy-6-(1-methylpyrrol-3-yl)-3-[(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5S,6S)-4,5-diacetyloxy-6-(1-methyl-3-pyrrolyl)-3-[[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5S,6S)-4,5-diacetyloxy-6-(1-methylpyrrol-3-yl)-3-[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5S,6S)-4,5-diacetoxy-6-(1-methylpyrrol-3-yl)-3-[(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl ester Formula: C31H41NO17 MolecularWeight: 699.65374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)C2=CN(C=C2)C)OC(=O)C)OC(=O)C)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C2=CN(C=C2)C)OC(=O)C)OC(=O)C)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C31H41NO17/c1-14(33)40-12-22-26(28(44-18(5)37)27(43-17(4)36)24(47-22)21-9-10-32(8)11-21)49-31-30(46-20(7)39)29(45-19(6)38)25(42-16(3)35)23(48-31)13-41-15(2)34/h9-11,22-31H,12-13H2,1-8H3/t22-,23-,24+,25-,26-,27+,28+,29+,30-,31-/m1/s1