(2S,4R,6R)-6-[(2S)-2,3-dimethoxypropyl]-5,5-dimethyl-4-(phenylcarbonyloxy)oxane-2-carboxylic acid

Systemtic Name: (2S,4R,6R)-6-[(2S)-2,3-dimethoxypropyl]-5,5-dimethyl-4-(phenylcarbonyloxy)oxane-2-carboxylic acid Openeye Name: (2S,4R,6R)-4-benzoyloxy-6-[(2S)-2,3-dimethoxypropyl]-5,5-dimethyl-tetrahydropyran-2-carboxylic acid CAS Name: (2S,4R,6R)-4-benzoyloxy-6-[(2S)-2,3-dimethoxypropyl]-5,5-dimethyl-2-oxanecarboxylic acid IUPAC Name: (2S,4R,6R)-4-benzoyloxy-6-[(2S)-2,3-dimethoxypropyl]-5,5-dimethyloxane-2-carboxylic acid Traditional Name: (2S,4R,6R)-4-benzoyloxy-6-[(2S)-2,3-dimethoxypropyl]-5,5-dimethyl-tetrahydropyran-2-carboxylic acid Formula: C20H28O7 MolecularWeight: 380.43212

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC(OC1CC(COC)OC)C(=O)O)OC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1([C@@H](C[C@H](O[C@@H]1C[C@@H](COC)OC)C(=O)O)OC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C20H28O7/c1-20(2)16(10-14(25-4)12-24-3)26-15(18(21)22)11-17(20)27-19(23)13-8-6-5-7-9-13/h5-9,14-17H,10-12H2,1-4H3,(H,21,22)/t14-,15-,16+,17+/m0/s1