[(2S,3S,4S,5R,6R)-4-acetyloxy-2-methyl-5-oxidanyl-6-prop-2-enoxy-oxan-3-yl] benzoate

Systemtic Name: [(2S,3S,4S,5R,6R)-4-acetyloxy-2-methyl-5-oxidanyl-6-prop-2-enoxy-oxan-3-yl] benzoate Openeye Name: [(2S,3S,4S,5R,6R)-4-acetoxy-6-allyloxy-5-hydroxy-2-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2S,3S,4S,5R,6R)-4-acetyloxy-5-hydroxy-2-methyl-6-prop-2-enoxy-3-oxanyl] ester IUPAC Name: [(2S,3S,4S,5R,6R)-4-acetyloxy-5-hydroxy-2-methyl-6-prop-2-enoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2S,3S,4S,5R,6R)-4-acetoxy-6-allyloxy-5-hydroxy-2-methyl-tetrahydropyran-3-yl] ester Formula: C18H22O7 MolecularWeight: 350.36308

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OCC=C)O)OC(=O)C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OCC=C)O)OC(=O)C)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H22O7/c1-4-10-22-18-14(20)16(24-12(3)19)15(11(2)23-18)25-17(21)13-8-6-5-7-9-13/h4-9,11,14-16,18,20H,1,10H2,2-3H3/t11-,14+,15-,16-,18+/m0/s1