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

Systemtic Name: [(2R,3S,4R,5R,6S)-5-acetamido-3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxymethyl]-3,4,5-triacetyloxy-oxan-2-yl]oxy-4-acetyloxy-6-prop-2-enoxy-oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4R,5R,6S)-5-acetamido-3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5R,6R)-3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxymethyl]-3,4,5-triacetoxy-tetrahydropyran-2-yl]oxy-4-acetoxy-6-allyloxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4R,5R,6S)-5-acetamido-3-[[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxymethyl]-3,4,5-triacetyloxy-2-oxanyl]oxy]-4-acetyloxy-6-prop-2-enoxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4R,5R,6S)-5-acetamido-3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxymethyl]-3,4,5-triacetyloxyoxan-2-yl]oxy-4-acetyloxy-6-prop-2-enoxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4R,5R,6S)-5-acetamido-3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5R,6R)-3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxymethyl]-3,4,5-triacetoxy-tetrahydropyran-2-yl]oxy-4-acetoxy-6-allyloxy-tetrahydropyran-2-yl]methyl ester Formula: C41H58N2O24 MolecularWeight: 962.89822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OCC=C)COC(=O)C)OC2C(C(C(C(O2)COC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OCC=C)COC(=O)C)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C41H58N2O24/c1-12-13-54-39-30(42-17(2)44)36(61-24(9)51)33(28(64-39)15-56-20(5)47)67-41-38(63-26(11)53)37(62-25(10)52)34(59-22(7)49)29(66-41)16-57-40-31(43-18(3)45)35(60-23(8)50)32(58-21(6)48)27(65-40)14-55-19(4)46/h12,27-41H,1,13-16H2,2-11H3,(H,42,44)(H,43,45)/t27-,28-,29-,30-,31-,32+,33-,34+,35-,36-,37+,38-,39+,40-,41+/m1/s1