[(2S,3R,4S,5R)-5-[(1S)-1-acetyloxytridecyl]-4-phenylmethoxy-2-prop-2-enoxy-oxolan-3-yl] ethanoate

Systemtic Name: [(2S,3R,4S,5R)-5-[(1S)-1-acetyloxytridecyl]-4-phenylmethoxy-2-prop-2-enoxy-oxolan-3-yl] ethanoate Openeye Name: [(2S,3R,4S,5R)-5-[(1S)-1-acetoxytridecyl]-2-allyloxy-4-benzyloxy-tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [(2S,3R,4S,5R)-5-[(1S)-1-acetyloxytridecyl]-4-phenylmethoxy-2-prop-2-enoxy-3-oxolanyl] ester IUPAC Name: [(2S,3R,4S,5R)-5-[(1S)-1-acetyloxytridecyl]-4-phenylmethoxy-2-prop-2-enoxyoxolan-3-yl] acetate Traditional Name: acetic acid [(2S,3R,4S,5R)-5-[(1S)-1-acetoxytridecyl]-2-allyloxy-4-benzoxy-tetrahydrofuran-3-yl] ester Formula: C31H48O7 MolecularWeight: 532.70862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1C(C(C(O1)OCC=C)OC(=O)C)OCC2=CC=CC=C2)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCC[C@@H]([C@@H]1[C@@H]([C@H]([C@H](O1)OCC=C)OC(=O)C)OCC2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C31H48O7/c1-5-7-8-9-10-11-12-13-14-18-21-27(36-24(3)32)28-29(35-23-26-19-16-15-17-20-26)30(37-25(4)33)31(38-28)34-22-6-2/h6,15-17,19-20,27-31H,2,5,7-14,18,21-23H2,1,3-4H3/t27-,28+,29-,30+,31-/m0/s1