{"entity_id": 133, "category": "essentialoil", "category_readable": "Essential Oil", "entity_alias": "ylangylang-oil", "entity_alias_basket": "ylangylang-oil", "entity_alias_readable": "Ylang-Ylang", "entity_alias_synonyms": "Ylang-Ylang", "entity_alias_url": "https://en.wikipedia.org/wiki/Cananga_odorata", "natural_source_name": "Cananga", "natural_source_url": "https://en.wikipedia.org/wiki/Cananga", "molecules": [{"pubchem_id": 7362, "iupac_name": "furan-2-carbaldehyde", "common_name": "2-Furaldehyde", "smile": "C1=COC(=C1)C=O", "molecular_weight": 96.085, "hbd_count": 0, "hba_count": 2, "num_rotatablebonds": 1, "complexity": 70.5, "topological_polor_surfacearea": 30.2, "monoisotopic_mass": 96.021, "exact_mass": 96.021, "xlogp": "0.4", "charge": 0, "heavy_atom_count": 7, "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, 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"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": "117500-35-3@65-85-0", "fema_number": "2131", "fema_flavor_profile": "Pungent, Sour", "odor": "odorless or with a slight benzaldehyde odor@faint, pleasant odor", "taste": "almost tasteless /benzoic acid usp/@bitter taste@taste detection 8.5x10+1 ppm /media and purity not specified/", "functional_groups": "carboxylic acid derivative@carboxylic acid@aromatic compound", "inchi": "InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)", "volume3d": "98.2", "fooddb_flavor_profile": "balsam@urine@faint", "super_sweet": null, "bitter": 0, "supersweetdb_id": null, "bitterdb_id": null, "fooddb_id": "FDB008739", "flavornet_id": 1, "fenoroli_and_os": 1, "natural": 1, "unknown_natural": 0, "synthetic": 0, "flavor_profile": "balsam@urine@faint"}, {"pubchem_id": 7731, "iupac_name": "1-methoxy-4-methylbenzene", "common_name": "4-Methylanisole", "smile": "CC1=CC=C(C=C1)OC", "molecular_weight": 122.167, "hbd_count": 0, "hba_count": 1, "num_rotatablebonds": 1, "complexity": 72.6, "topological_polor_surfacearea": 9.2, "monoisotopic_mass": 122.073, "exact_mass": 122.073, "xlogp": "2.7", "charge": 0, "heavy_atom_count": 9, "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": "104-93-8@3494-45-9", "fema_number": "2681", "fema_flavor_profile": "Floral", "odor": "strong floral odor@pungent odor suggestive of ylang-ylang@sharp, fruity sweet odor", "taste": "nutty taste", "functional_groups": "ether@alkyl aryl ether@aromatic compound", "inchi": "InChI=1S/C8H10O/c1-7-3-5-8(9-2)6-4-7/h3-6H,1-2H3", 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