methyl (1S,4aS,6S,7R,7aS)-6,7-diacetyloxy-7-methyl-1-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate

Systemtic Name: methyl (1S,4aS,6S,7R,7aS)-6,7-diacetyloxy-7-methyl-1-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate Openeye Name: methyl (1S,4aS,6S,7R,7aS)-6,7-diacetoxy-7-methyl-1-[(2S,3R,4S,5R,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate CAS Name: (1S,4aS,6S,7R,7aS)-6,7-diacetyloxy-7-methyl-1-[[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid methyl ester IUPAC Name: methyl (1S,4aS,6S,7R,7aS)-6,7-diacetyloxy-7-methyl-1-[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate Traditional Name: (1S,4aS,6S,7R,7aS)-6,7-diacetoxy-7-methyl-1-[(2S,3R,4S,5R,6R)-3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid methyl ester Formula: C29H38O17 MolecularWeight: 658.60182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC2C3C(CC(C3(C)OC(=O)C)OC(=O)C)C(=CO2)C(=O)OC)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)O[C@H]2[C@H]3[C@H](C[C@@H]([C@]3(C)OC(=O)C)OC(=O)C)C(=CO2)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C29H38O17/c1-12(30)38-11-20-23(41-14(3)32)24(42-15(4)33)25(43-16(5)34)28(44-20)45-27-22-18(19(10-39-27)26(36)37-8)9-21(40-13(2)31)29(22,7)46-17(6)35/h10,18,20-25,27-28H,9,11H2,1-8H3/t18-,20-,21+,22-,23-,24+,25-,27+,28+,29+/m1/s1