(4S)-4-methyl-5-[(2R,4S,5R)-5-oxidanyl-2-phenyl-1,3-dioxan-4-yl]pentanoic acid

Systemtic Name: (4S)-4-methyl-5-[(2R,4S,5R)-5-oxidanyl-2-phenyl-1,3-dioxan-4-yl]pentanoic acid Openeye Name: (4S)-5-[(2R,4S,5R)-5-hydroxy-2-phenyl-1,3-dioxan-4-yl]-4-methyl-pentanoic acid CAS Name: (4S)-5-[(2R,4S,5R)-5-hydroxy-2-phenyl-1,3-dioxan-4-yl]-4-methylpentanoic acid IUPAC Name: (4S)-5-[(2R,4S,5R)-5-hydroxy-2-phenyl-1,3-dioxan-4-yl]-4-methylpentanoic acid Traditional Name: (4S)-5-[(2R,4S,5R)-5-hydroxy-2-phenyl-1,3-dioxan-4-yl]-4-methyl-valeric acid Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)O)CC1C(COC(O1)C2=CC=CC=C2)O

Isomeric SMILES

C[C@@H](CCC(=O)O)C[C@H]1[C@@H](CO[C@H](O1)C2=CC=CC=C2)O

InChI

InChI=1S/C16H22O5/c1-11(7-8-15(18)19)9-14-13(17)10-20-16(21-14)12-5-3-2-4-6-12/h2-6,11,13-14,16-17H,7-10H2,1H3,(H,18,19)/t11-,13+,14-,16+/m0/s1