[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5R)-5-(hydroxymethyl)-3,4-bis(phenylcarbonyloxy)-2-(phenylcarbonyloxymethyl)oxolan-2-yl]oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate

Systemtic Name: [(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5R)-5-(hydroxymethyl)-3,4-bis(phenylcarbonyloxy)-2-(phenylcarbonyloxymethyl)oxolan-2-yl]oxy-3,4,5-tris(phenylcarbonyloxy)oxan-2-yl]methyl benzoate Openeye Name: [(2R,3R,4S,5R,6R)-3,4,5-tribenzoyloxy-6-[(2S,3S,4R,5R)-3,4-dibenzoyloxy-2-(benzoyloxymethyl)-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3R,4S,5R,6R)-3,4,5-tribenzoyloxy-6-[[(2S,3S,4R,5R)-3,4-dibenzoyloxy-2-(benzoyloxymethyl)-5-(hydroxymethyl)-2-oxolanyl]oxy]-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6R)-3,4,5-tribenzoyloxy-6-[(2S,3S,4R,5R)-3,4-dibenzoyloxy-2-(benzoyloxymethyl)-5-(hydroxymethyl)oxolan-2-yl]oxyoxan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3R,4S,5R,6R)-3,4,5-tribenzoyloxy-6-[(2S,3S,4R,5R)-3,4-dibenzoyloxy-2-(benzoyloxymethyl)-5-methylol-tetrahydrofuran-2-yl]oxy-tetrahydropyran-2-yl]methyl ester Formula: C61H50O18 MolecularWeight: 1071.0389

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)COC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)OC(=O)C8=CC=CC=C8)OC(=O)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)COC(=O)C6=CC=CC=C6)OC(=O)C7=CC=CC=C7)OC(=O)C8=CC=CC=C8)OC(=O)C9=CC=CC=C9

InChI

InChI=1S/C61H50O18/c62-36-46-49(74-56(66)42-28-14-4-15-29-42)52(77-59(69)45-34-20-7-21-35-45)61(78-46,38-71-54(64)40-24-10-2-11-25-40)79-60-51(76-58(68)44-32-18-6-19-33-44)50(75-57(67)43-30-16-5-17-31-43)48(73-55(65)41-26-12-3-13-27-41)47(72-60)37-70-53(63)39-22-8-1-9-23-39/h1-35,46-52,60,62H,36-38H2/t46-,47-,48-,49-,50+,51-,52+,60-,61+/m1/s1