[(2R,3S,4R,5R,6R)-3,4-diacetyloxy-6-[(2S)-2-phenylmethoxy-2-[(2R,3S,4S,5S,6S)-3,4,5,6-tetrakis(phenylmethoxy)oxan-2-yl]ethoxy]-5-(prop-2-enoxycarbonylamino)oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,4R,5R,6R)-3,4-diacetyloxy-6-[(2S)-2-phenylmethoxy-2-[(2R,3S,4S,5S,6S)-3,4,5,6-tetrakis(phenylmethoxy)oxan-2-yl]ethoxy]-5-(prop-2-enoxycarbonylamino)oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,4R,5R,6R)-3,4-diacetoxy-5-(allyloxycarbonylamino)-6-[(2S)-2-benzyloxy-2-[(2R,3S,4S,5S,6S)-3,4,5,6-tetrabenzyloxytetrahydropyran-2-yl]ethoxy]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,4R,5R,6R)-3,4-diacetyloxy-5-[[oxo(prop-2-enoxy)methyl]amino]-6-[(2S)-2-phenylmethoxy-2-[(2R,3S,4S,5S,6S)-3,4,5,6-tetrakis(phenylmethoxy)-2-oxanyl]ethoxy]-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,4R,5R,6R)-3,4-diacetyloxy-6-[(2S)-2-phenylmethoxy-2-[(2R,3S,4S,5S,6S)-3,4,5,6-tetrakis(phenylmethoxy)oxan-2-yl]ethoxy]-5-(prop-2-enoxycarbonylamino)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,4R,5R,6R)-3,4-diacetoxy-5-(allyloxycarbonylamino)-6-[(2S)-2-benzoxy-2-[(2R,3S,4S,5S,6S)-3,4,5,6-tetrabenzoxytetrahydropyran-2-yl]ethoxy]tetrahydropyran-2-yl]methyl ester Formula: C58H65NO16 MolecularWeight: 1032.1338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OCC(C2C(C(C(C(O2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)NC(=O)OCC=C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]([C@@H]2[C@H]([C@@H]([C@@H]([C@H](O2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)NC(=O)OCC=C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C58H65NO16/c1-5-31-64-58(63)59-49-52(73-41(4)62)51(72-40(3)61)48(38-65-39(2)60)74-56(49)71-37-47(66-32-42-21-11-6-12-22-42)50-53(67-33-43-23-13-7-14-24-43)54(68-34-44-25-15-8-16-26-44)55(69-35-45-27-17-9-18-28-45)57(75-50)70-36-46-29-19-10-20-30-46/h5-30,47-57H,1,31-38H2,2-4H3,(H,59,63)/t47-,48+,49+,50+,51+,52+,53+,54-,55-,56+,57-/m0/s1