(E,2R,5R,6S)-2,5-dimethyl-6-phenylsulfanyl-hept-3-ene-1,5-diol

Systemtic Name: (E,2R,5R,6S)-2,5-dimethyl-6-phenylsulfanyl-hept-3-ene-1,5-diol Openeye Name: (E,2R,5R,6S)-2,5-dimethyl-6-phenylsulfanyl-hept-3-ene-1,5-diol CAS Name: (E,2R,5R,6S)-2,5-dimethyl-6-(phenylthio)-3-heptene-1,5-diol IUPAC Name: (E,2R,5R,6S)-2,5-dimethyl-6-phenylsulfanylhept-3-ene-1,5-diol Traditional Name: (E,2R,5R,6S)-2,5-dimethyl-6-(phenylthio)hept-3-ene-1,5-diol Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C=CC(C)(C(C)SC1=CC=CC=C1)O

Isomeric SMILES

C[C@@H](CO)/C=C/[C@](C)([C@H](C)SC1=CC=CC=C1)O

InChI

InChI=1S/C15H22O2S/c1-12(11-16)9-10-15(3,17)13(2)18-14-7-5-4-6-8-14/h4-10,12-13,16-17H,11H2,1-3H3/b10-9+/t12-,13+,15-/m1/s1