(phenylmethyl) (2R,3S,5S)-2-methyl-3,5,6-tris(oxidanyl)hexanoate

Systemtic Name: (phenylmethyl) (2R,3S,5S)-2-methyl-3,5,6-tris(oxidanyl)hexanoate Openeye Name: benzyl (2R,3S,5S)-3,5,6-trihydroxy-2-methyl-hexanoate CAS Name: (2R,3S,5S)-3,5,6-trihydroxy-2-methylhexanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,3S,5S)-3,5,6-trihydroxy-2-methylhexanoate Traditional Name: (2R,3S,5S)-3,5,6-trihydroxy-2-methyl-hexanoic acid benzyl ester Formula: C14H20O5 MolecularWeight: 268.3056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O5/c1-10(13(17)7-12(16)8-15)14(18)19-9-11-5-3-2-4-6-11/h2-6,10,12-13,15-17H,7-9H2,1H3/t10-,12+,13+/m1/s1