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"num_rotatablebonds": 7, "complexity": 269.0, "topological_polor_surfacearea": 20.2, "monoisotopic_mass": 222.198, "exact_mass": 222.198, "xlogp": "4.6", "charge": 0, "heavy_atom_count": 16, "atom_stereo_count": 1, "defined_atom_stereocenter_count": 0, "undefined_atom_stereocenter_count": 1, "bond_stereo_count": 1, "defined_bond_stereocenter_count": 1, "undefined_bond_stereocenter_count": 0, "isotope_atom_count": 0, "covalently_bonded_unit_count": 1, "cas_id": "40716-66-3@7212-44-4@142-50-7", "fema_number": "2772", "fema_flavor_profile": "Fir, Linoleum, Pine", "odor": null, "taste": null, "functional_groups": "hydroxy compound@alcohol@tertiary alcohol@alkene", "inchi": "InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11+", "volume3d": "201.1", "fooddb_flavor_profile": "citrus@wax@waxy@floral@woody@wood@flower@green", "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": "FDB014378", "flavornet_id": 1, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "citrus@wax@waxy@floral@woody@wood@flower@green"}, {"pubchem_id": 2879, "iupac_name": "4-methylphenol", "common_name": "P-Cresol", "smile": "CC1=CC=C(C=C1)O", "molecular_weight": 108.14, "hbd_count": 1, "hba_count": 1, "num_rotatablebonds": 0, "complexity": 62.8, "topological_polor_surfacearea": 20.2, "monoisotopic_mass": 108.058, "exact_mass": 108.058, "xlogp": "1.9", "charge": 0, "heavy_atom_count": 8, "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": "106-44-5@1319-77-3", "fema_number": "2337", "fema_flavor_profile": "Pungent, Stable", "odor": "phenolic odor@sweet, tarry odor", "taste": null, "functional_groups": "hydroxy compound@phenol or hydroxyhetarene@aromatic compound", "inchi": "InChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3", "volume3d": "92.6", "fooddb_flavor_profile": "smoke@animal@narcissus@phenol@mimosa@medicine@medicinal@phenolic", "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": "FDB008789", "flavornet_id": 1, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "smoke@animal@narcissus@phenol@mimosa@medicine@medicinal@phenolic"}, {"pubchem_id": 6549, "iupac_name": "3,7-dimethylocta-1,6-dien-3-ol", "common_name": "Linalool", "smile": "CC(=CCCC(C)(C=C)O)C", "molecular_weight": 154.253, "hbd_count": 1, "hba_count": 1, "num_rotatablebonds": 4, "complexity": 154.0, "topological_polor_surfacearea": 20.2, "monoisotopic_mass": 154.136, "exact_mass": 154.136, "xlogp": "2.7", "charge": 0, "heavy_atom_count": 11, "atom_stereo_count": 1, "defined_atom_stereocenter_count": 0, "undefined_atom_stereocenter_count": 1, "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": "22564-99-4@78-70-6", "fema_number": "2635", "fema_flavor_profile": "Coriander, Floral, Lavender, Lemon, Rose", "odor": "odor similar to that of bergamot oil and french lavender@typical floral odor free from camphoraceous and terpenic notes@floral, spicy, wood odor@flowery-fresh odor and reminiscent of lily of the valley", "taste": "taste characteristics at 30 ppm: floral, woody, sweet with a green, spicy tropical nuance@flavor characteristics: light, floral@spicy, citrus taste", "functional_groups": "hydroxy compound@alcohol@tertiary alcohol@alkene", "inchi": "InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3", "volume3d": "139.5", "fooddb_flavor_profile": "lemon@citrus@orange@floral@sweet@woody@blueberry@bois de rose@lavender@flower@green", "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": "FDB014940", "flavornet_id": 1, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "lemon@citrus@orange@floral@sweet@woody@blueberry@bois de rose@lavender@flower@green"}, {"pubchem_id": 5281929, "iupac_name": "methyl 2-[(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetate", "common_name": "Methyl jasmonate", "smile": "CCC=CCC1C(CCC1=O)CC(=O)OC", "molecular_weight": 224.3, "hbd_count": 0, "hba_count": 3, "num_rotatablebonds": 6, "complexity": 281.0, "topological_polor_surfacearea": 43.4, "monoisotopic_mass": 224.141, "exact_mass": 224.141, "xlogp": "1.9", "charge": 0, "heavy_atom_count": 16, "atom_stereo_count": 2, "defined_atom_stereocenter_count": 2, "undefined_atom_stereocenter_count": 0, "bond_stereo_count": 1, "defined_bond_stereocenter_count": 1, "undefined_bond_stereocenter_count": 0, "isotope_atom_count": 0, "covalently_bonded_unit_count": 1, "cas_id": "20073-13-6@1211-29-6", "fema_number": "3410", "fema_flavor_profile": "Floral", "odor": "sharp persistent odor", "taste": null, "functional_groups": "carbonyl compound@ketone@carboxylic acid derivative@carboxylic acid ester@alkene", "inchi": "InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4-/t10-,11-/m1/s1", "volume3d": "186.5", "fooddb_flavor_profile": null, "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": null, "flavornet_id": 1, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": null}, {"pubchem_id": 8294, "iupac_name": "3,7-dimethylocta-1,6-dien-3-yl acetate", "common_name": "Linalyl Acetate", "smile": "CC(=CCCC(C)(C=C)OC(=O)C)C", "molecular_weight": 196.29, "hbd_count": 0, "hba_count": 2, "num_rotatablebonds": 6, "complexity": 237.0, "topological_polor_surfacearea": 26.3, "monoisotopic_mass": 196.146, "exact_mass": 196.146, "xlogp": "3.3", "charge": 0, "heavy_atom_count": 14, "atom_stereo_count": 1, "defined_atom_stereocenter_count": 0, "undefined_atom_stereocenter_count": 1, "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": "40135-38-4@115-95-7", "fema_number": "2636", "fema_flavor_profile": "Fruit", "odor": "...floral-fruity odor, reminiscent of bergamot and it also has some pear character@bergamot-lavender odor@sweet, floral-fruity odor recalling bergamot and pear.", "taste": "persistent sweet, acrid taste@sweet, fruity, pear-like with a faintly floral note", "functional_groups": "carboxylic acid derivative@carboxylic acid ester@alkene", "inchi": "InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3", "volume3d": "169.4", "fooddb_flavor_profile": "citrus@fruit@sweet@woody@bergamot@lavender@green", "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": "FDB019133", "flavornet_id": 1, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "citrus@fruit@sweet@woody@bergamot@lavender@green"}, {"pubchem_id": 643820, "iupac_name": "(2Z)-3,7-dimethylocta-2,6-dien-1-ol", "common_name": "nerol", "smile": "CC(=CCCC(=CCO)C)C", "molecular_weight": 154.253, "hbd_count": 1, "hba_count": 1, "num_rotatablebonds": 4, "complexity": 150.0, "topological_polor_surfacearea": 20.2, "monoisotopic_mass": 154.136, "exact_mass": 154.136, "xlogp": "2.9", "charge": 0, "heavy_atom_count": 11, "atom_stereo_count": 0, "defined_atom_stereocenter_count": 0, "undefined_atom_stereocenter_count": 0, "bond_stereo_count": 1, "defined_bond_stereocenter_count": 1, "undefined_bond_stereocenter_count": 0, "isotope_atom_count": 0, "covalently_bonded_unit_count": 1, "cas_id": "106-25-2", "fema_number": "2770", "fema_flavor_profile": "Floral, Fruit", "odor": "sweet rose@the odor of pure nerol is sweet, rosy refreshing and wet\" seashore\"", "taste": "bitter flavor@fresh, citrus, floral, green, sweet, lemon/lime and waxy with a spicy depth", "functional_groups": "hydroxy compound@alcohol@primary alcohol@alkene", "inchi": "InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7-", "volume3d": "140.1", "fooddb_flavor_profile": "citrus@magnolia@neroli@bitter@sweet@natural", "super_sweet": null, "bitter": 1, "supersweetdb_id": null, "bitterdb_id": "791", "fooddb_id": "FDB014945", "flavornet_id": 1, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "neroli@natural@citrus@sweet@magnolia@bitter"}, {"pubchem_id": 1549018, "iupac_name": "3-methyl-2-[(Z)-pent-2-enyl]cyclopent-2-en-1-one", "common_name": "cis-Jasmone", "smile": "CCC=CCC1=C(CCC1=O)C", "molecular_weight": 164.248, "hbd_count": 0, "hba_count": 1, "num_rotatablebonds": 3, "complexity": 233.0, "topological_polor_surfacearea": 17.1, "monoisotopic_mass": 164.12, "exact_mass": 164.12, "xlogp": "2.2", "charge": 0, "heavy_atom_count": 12, "atom_stereo_count": 0, "defined_atom_stereocenter_count": 0, "undefined_atom_stereocenter_count": 0, "bond_stereo_count": 1, "defined_bond_stereocenter_count": 1, "undefined_bond_stereocenter_count": 0, "isotope_atom_count": 0, "covalently_bonded_unit_count": 1, "cas_id": "488-10-8", "fema_number": "3196", "fema_flavor_profile": "Floral", "odor": "odor of jasmine@woody, herbal and floral, with a citrus nuance", "taste": "woody, bitter, tea, with a citrus and floral nuance at 25 ppm", "functional_groups": "carbonyl compound@ketone@alkene", "inchi": "InChI=1S/C11H16O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5H,3,6-8H2,1-2H3/b5-4-", "volume3d": "145.3", "fooddb_flavor_profile": "jasmine@jasmin@herbal@floral@woody@celery@spicy", "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": "FDB014294", "flavornet_id": 0, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "jasmine@jasmin@herbal@floral@woody@celery@spicy"}, {"pubchem_id": 244, 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