[(2R,3S,4R,5S,6S)-5-acetamido-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4-acetyloxy-6-prop-2-enyl-oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4R,5S,6S)-5-acetamido-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4-acetyloxy-6-prop-2-enyl-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4R,5S,6S)-5-acetamido-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-4-acetoxy-6-allyl-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4R,5S,6S)-5-acetamido-3-[[(2S,3R,4R,5S,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-4-acetyloxy-6-prop-2-enyl-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4R,5S,6S)-5-acetamido-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4-acetyloxy-6-prop-2-enyloxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4R,5S,6S)-5-acetamido-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-4-acetoxy-6-allyl-tetrahydropyran-2-yl]methyl ester Formula: C29H42N2O15 MolecularWeight: 658.64818

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(OC(C(C1OC(=O)C)OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)COC(=O)C)CC=C

Isomeric SMILES

CC(=O)N[C@H]1[C@@H](O[C@@H]([C@H]([C@@H]1OC(=O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)COC(=O)C)CC=C

InChI

InChI=1S/C29H42N2O15/c1-9-10-20-23(30-13(2)32)27(42-18(7)37)26(21(44-20)11-39-15(4)34)46-29-24(31-14(3)33)28(43-19(8)38)25(41-17(6)36)22(45-29)12-40-16(5)35/h9,20-29H,1,10-12H2,2-8H3,(H,30,32)(H,31,33)/t20-,21+,22+,23-,24+,25+,26+,27+,28+,29-/m0/s1