(3S,4R,5S,6S)-4,6-dimethyl-5-phenylmethoxy-heptane-1,3,7-triol

Systemtic Name: (3S,4R,5S,6S)-4,6-dimethyl-5-phenylmethoxy-heptane-1,3,7-triol Openeye Name: (3S,4R,5S,6S)-5-benzyloxy-4,6-dimethyl-heptane-1,3,7-triol CAS Name: (3S,4R,5S,6S)-4,6-dimethyl-5-phenylmethoxyheptane-1,3,7-triol IUPAC Name: (3S,4R,5S,6S)-4,6-dimethyl-5-phenylmethoxyheptane-1,3,7-triol Traditional Name: (3S,4R,5S,6S)-5-benzoxy-4,6-dimethyl-heptane-1,3,7-triol Formula: C16H26O4 MolecularWeight: 282.37524

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C(C(C)C(CCO)O)OCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CO)[C@@H]([C@H](C)[C@H](CCO)O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H26O4/c1-12(10-18)16(13(2)15(19)8-9-17)20-11-14-6-4-3-5-7-14/h3-7,12-13,15-19H,8-11H2,1-2H3/t12-,13+,15-,16-/m0/s1