3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-[5-(phenylmethoxycarbonylamino)pentyl]oxan-2-olate

Systemtic Name: 3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-[5-(phenylmethoxycarbonylamino)pentyl]oxan-2-olate Openeye Name: 3,4,5-triacetoxy-6-(acetoxymethyl)-2-[5-(benzyloxycarbonylamino)pentyl]tetrahydropyran-2-olate CAS Name: 3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-[5-(phenylmethoxycarbonylamino)pentyl]-2-oxanolate IUPAC Name: 3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-[5-(phenylmethoxycarbonylamino)pentyl]oxan-2-olate Traditional Name: 3,4,5-triacetoxy-6-(acetoxymethyl)-2-[5-(benzyloxycarbonylamino)pentyl]tetrahydropyran-2-olate Formula: C27H36NO12- MolecularWeight: 566.57424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)(CCCCCNC(=O)OCC2=CC=CC=C2)[O-])OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)(CCCCCNC(=O)OCC2=CC=CC=C2)[O-])OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C27H36NO12/c1-17(29)35-16-22-23(37-18(2)30)24(38-19(3)31)25(39-20(4)32)27(34,40-22)13-9-6-10-14-28-26(33)36-15-21-11-7-5-8-12-21/h5,7-8,11-12,22-25H,6,9-10,13-16H2,1-4H3,(H,28,33)/q-1