[(2R)-2-[(2S,3S,4R,5S)-5-[(2R,3S,4S)-2-[(1R)-1,2-bis(phenylcarbonyloxy)ethyl]-5-oxidanylidene-4-(phenylcarbonyloxy)oxolan-3-yl]oxy-3,4-bis(phenylcarbonyloxy)oxolan-2-yl]-2-(phenylcarbonyloxy)ethyl] benzoate

Systemtic Name: [(2R)-2-[(2S,3S,4R,5S)-5-[(2R,3S,4S)-2-[(1R)-1,2-bis(phenylcarbonyloxy)ethyl]-5-oxidanylidene-4-(phenylcarbonyloxy)oxolan-3-yl]oxy-3,4-bis(phenylcarbonyloxy)oxolan-2-yl]-2-(phenylcarbonyloxy)ethyl] benzoate Openeye Name: [(2R)-2-benzoyloxy-2-[(2S,3S,4R,5S)-3,4-dibenzoyloxy-5-[(2R,3S,4S)-4-benzoyloxy-2-[(1R)-1,2-dibenzoyloxyethyl]-5-oxo-tetrahydrofuran-3-yl]oxy-tetrahydrofuran-2-yl]ethyl] benzoate CAS Name: benzoic acid [(2R)-2-benzoyloxy-2-[(2S,3S,4R,5S)-3,4-dibenzoyloxy-5-[[(2R,3S,4S)-4-benzoyloxy-2-[(1R)-1,2-dibenzoyloxyethyl]-5-oxo-3-oxolanyl]oxy]-2-oxolanyl]ethyl] ester IUPAC Name: [(2R)-2-benzoyloxy-2-[(2S,3S,4R,5S)-3,4-dibenzoyloxy-5-[(2R,3S,4S)-4-benzoyloxy-2-[(1R)-1,2-dibenzoyloxyethyl]-5-oxooxolan-3-yl]oxyoxolan-2-yl]ethyl] benzoate Traditional Name: benzoic acid [(2R)-2-benzoyloxy-2-[(2S,3S,4R,5S)-3,4-dibenzoyloxy-5-[(2R,3S,4S)-4-benzoyloxy-2-[(1R)-1,2-dibenzoyloxyethyl]-5-keto-tetrahydrofuran-3-yl]oxy-tetrahydrofuran-2-yl]ethyl] ester Formula: C61H48O18 MolecularWeight: 1069.02302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC(C2C(C(C(O2)OC3C(C(=O)OC3C(COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=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]([C@H]2[C@@H]([C@H]([C@@H](O2)O[C@@H]3[C@@H](C(=O)O[C@@H]3[C@@H](COC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=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/C61H48O18/c62-53(38-22-8-1-9-23-38)70-36-45(72-55(64)40-26-12-3-13-27-40)47-49(51(60(69)74-47)76-58(67)43-32-18-6-19-33-43)79-61-52(77-59(68)44-34-20-7-21-35-44)50(75-57(66)42-30-16-5-17-31-42)48(78-61)46(73-56(65)41-28-14-4-15-29-41)37-71-54(63)39-24-10-2-11-25-39/h1-35,45-52,61H,36-37H2/t45-,46-,47-,48+,49+,50+,51+,52-,61+/m1/s1