[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[3-oxidanyl-4-(2-pyridin-2-ylethanoyl)phenoxy]oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[3-oxidanyl-4-(2-pyridin-2-ylethanoyl)phenoxy]oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-[3-hydroxy-4-[2-(2-pyridyl)acetyl]phenoxy]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[3-hydroxy-4-[1-oxo-2-(2-pyridinyl)ethyl]phenoxy]-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[3-hydroxy-4-(2-pyridin-2-ylacetyl)phenoxy]oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-[3-hydroxy-4-[2-(2-pyridyl)acetyl]phenoxy]tetrahydropyran-2-yl]methyl ester Formula: C27H29NO12 MolecularWeight: 559.51866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2=CC(=C(C=C2)C(=O)CC3=CC=CC=N3)O)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)OC2=CC(=C(C=C2)C(=O)CC3=CC=CC=N3)O)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C27H29NO12/c1-14(29)35-13-23-24(36-15(2)30)25(37-16(3)31)26(38-17(4)32)27(40-23)39-19-8-9-20(22(34)12-19)21(33)11-18-7-5-6-10-28-18/h5-10,12,23-27,34H,11,13H2,1-4H3/t23-,24-,25+,26-,27-/m1/s1