{"pubchem_id": 985, "iupac_name": "hexadecanoic acid", "common_name": "palmitic acid", "smile": "CCCCCCCCCCCCCCCC(=O)O", "molecular_weight": 256.43, "hbd_count": 1, "hba_count": 2, "num_rotatablebonds": 14, "complexity": 178.0, "topological_polor_surfacearea": 37.3, "monoisotopic_mass": 256.24, "exact_mass": 256.24, "xlogp": "6.4", "charge": 0, "heavy_atom_count": 18, "atom_stereo_count": 0, "defined_atom_stereocenter_count": 0, "undefined_atom_stereocenter_count": 0, "bond_stereo_count": 0, "defined_bond_stereocenter_count": 0, "undefined_bond_stereocenter_count": 0, "isotope_atom_count": 0, "covalently_bonded_unit_count": 1, "cas_id": "159733-92-3@57-10-3@67701-02-4", "fema_number": "2832", "fema_flavor_profile": null, "odor": null, "taste": null, "functional_groups": "carboxylic acid derivative@carboxylic acid", "inchi": "InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)", "volume3d": "229.5", "fooddb_flavor_profile": "fatty@slightly waxy", "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": "FDB011679", "flavornet_id": 0, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "fatty@slightly waxy"}