[(2R,3R,4S,5S,6S)-6-methoxy-4-(3-oxidanylpropoxy)-2-(3-oxidanylpropoxymethyl)-5-(phenylcarbonyloxy)oxan-3-yl] benzoate

Systemtic Name: [(2R,3R,4S,5S,6S)-6-methoxy-4-(3-oxidanylpropoxy)-2-(3-oxidanylpropoxymethyl)-5-(phenylcarbonyloxy)oxan-3-yl] benzoate Openeye Name: [(2R,3R,4S,5S,6S)-5-benzoyloxy-4-(3-hydroxypropoxy)-2-(3-hydroxypropoxymethyl)-6-methoxy-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2R,3R,4S,5S,6S)-5-benzoyloxy-4-(3-hydroxypropoxy)-2-(3-hydroxypropoxymethyl)-6-methoxy-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5S,6S)-5-benzoyloxy-4-(3-hydroxypropoxy)-2-(3-hydroxypropoxymethyl)-6-methoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3R,4S,5S,6S)-5-benzoyloxy-4-(3-hydroxypropoxy)-2-(3-hydroxypropoxymethyl)-6-methoxy-tetrahydropyran-3-yl] ester Formula: C27H34O10 MolecularWeight: 518.55286

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(C(O1)COCCCO)OC(=O)C2=CC=CC=C2)OCCCO)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CO[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)COCCCO)OC(=O)C2=CC=CC=C2)OCCCO)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H34O10/c1-32-27-24(37-26(31)20-12-6-3-7-13-20)23(34-17-9-15-29)22(21(35-27)18-33-16-8-14-28)36-25(30)19-10-4-2-5-11-19/h2-7,10-13,21-24,27-29H,8-9,14-18H2,1H3/t21-,22-,23+,24+,27+/m1/s1