(phenylmethyl) (2R)-2-[(2S,3R,4S)-4-methyl-2-octyl-5-oxidanylidene-4-phenylsulfanyl-oxolan-3-yl]-2-phenylmethoxy-ethanoate

Systemtic Name: (phenylmethyl) (2R)-2-[(2S,3R,4S)-4-methyl-2-octyl-5-oxidanylidene-4-phenylsulfanyl-oxolan-3-yl]-2-phenylmethoxy-ethanoate Openeye Name: benzyl (2R)-2-benzyloxy-2-[(2S,3R,4S)-4-methyl-2-octyl-5-oxo-4-phenylsulfanyl-tetrahydrofuran-3-yl]acetate CAS Name: (2R)-2-[(2S,3R,4S)-4-methyl-2-octyl-5-oxo-4-(phenylthio)-3-oxolanyl]-2-phenylmethoxyacetic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-[(2S,3R,4S)-4-methyl-2-octyl-5-oxo-4-phenylsulfanyloxolan-3-yl]-2-phenylmethoxyacetate Traditional Name: (2R)-2-benzoxy-2-[(2S,3R,4S)-5-keto-4-methyl-2-octyl-4-(phenylthio)tetrahydrofuran-3-yl]acetic acid benzyl ester Formula: C35H42O5S MolecularWeight: 574.76998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(C(C(=O)O1)(C)SC2=CC=CC=C2)C(C(=O)OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCC[C@H]1[C@@H]([C@](C(=O)O1)(C)SC2=CC=CC=C2)[C@H](C(=O)OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C35H42O5S/c1-3-4-5-6-7-17-24-30-31(35(2,34(37)40-30)41-29-22-15-10-16-23-29)32(38-25-27-18-11-8-12-19-27)33(36)39-26-28-20-13-9-14-21-28/h8-16,18-23,30-32H,3-7,17,24-26H2,1-2H3/t30-,31+,32+,35-/m0/s1