[(2R,3R,4S,5R,6R)-2-but-3-en-2-yloxy-5-oxidanyl-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl] benzoate

Systemtic Name: [(2R,3R,4S,5R,6R)-2-but-3-en-2-yloxy-5-oxidanyl-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl] benzoate Openeye Name: [(2R,3R,4S,5R,6R)-4-benzyloxy-6-(benzyloxymethyl)-5-hydroxy-2-(1-methylallyloxy)tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2R,3R,4S,5R,6R)-2-but-3-en-2-yloxy-5-hydroxy-4-phenylmethoxy-6-(phenylmethoxymethyl)-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5R,6R)-2-but-3-en-2-yloxy-5-hydroxy-4-phenylmethoxy-6-(phenylmethoxymethyl)oxan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3R,4S,5R,6R)-4-benzoxy-6-(benzoxymethyl)-5-hydroxy-2-(1-methylallyloxy)tetrahydropyran-3-yl] ester Formula: C31H34O7 MolecularWeight: 518.59746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)OC1C(C(C(C(O1)COCC2=CC=CC=C2)O)OCC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C=C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CC=CC=C2)O)OCC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C31H34O7/c1-3-22(2)36-31-29(38-30(33)25-17-11-6-12-18-25)28(35-20-24-15-9-5-10-16-24)27(32)26(37-31)21-34-19-23-13-7-4-8-14-23/h3-18,22,26-29,31-32H,1,19-21H2,2H3/t22?,26-,27-,28+,29-,31-/m1/s1