{"id":21786,"npaid":"NPA021786","original_name":"Coralcuparene","mol_formula":"C14H16O3","mol_weight":"232.2790","exact_mass":"232.1099","inchikey":"GTBHBFNWPIAUKN-UHFFFAOYSA-N","smiles":"CC1=C(C=C(C(=C1)O)C2=CC(=O)CC2(C)C)O","cluster_id":6751,"node_id":4675,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C14H16O3/c1-8-4-13(17)10(6-12(8)16)11-5-9(15)7-14(11,2)3/h4-6,16-17H,7H2,1-3H3","m_plus_h":"233.1172","m_plus_na":"255.0991","origin_reference":{"doi":"10.1038/s41429-018-0067-6","pmid":29773898,"authors":"Kim, Ji-Yul; Woo, E-Eum; Lee, In-Kyoung; Yun, Bong-Sik","title":"New antioxidants from the culture broth of Hericium coralloides","journal":"Journal of Antibiotics","year":2018,"volume":"71","issue":"9","pages":"822-825"},"origin_organism":{"id":6864,"type":"Fungus","genus":"Hericium","species":"coralloides","taxon":{"id":1502,"name":"Hericium","rank":"genus","taxon_db":"mycobank","external_id":"17740","ncbi_id":40459,"ancestors":[{"id":599,"name":"Eukarya","rank":"domain","taxon_db":"mycobank","external_id":"0","ncbi_id":2759},{"id":600,"name":"Fungi","rank":"kingdom","taxon_db":"mycobank","external_id":"90157","ncbi_id":4751},{"id":1365,"name":"Basidiomycota","rank":"phylum","taxon_db":"mycobank","external_id":"90050","ncbi_id":5204},{"id":1366,"name":"Agaricomycetes","rank":"class","taxon_db":"mycobank","external_id":"501297","ncbi_id":155619},{"id":1488,"name":"Russulales","rank":"order","taxon_db":"mycobank","external_id":"90569","ncbi_id":452342},{"id":1500,"name":"Hericiaceae","rank":"family","taxon_db":"mycobank","external_id":"80854","ncbi_id":40458}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1038/s41429-018-0067-6","structure_smiles":"CC1=C(C=C(C(=C1)O)C2=CC(=O)CC2(C)C)O","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"npmrd","external_db_code":"NP0018114"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000134","name":"Phenols","chemont_id":"CHEMONTID:0000134","description":"Compounds containing a phenol moiety, which is a benzene bearing a hydroxyl group."},"smiles":"CC1=CC(O)=C(C=C1O)C1=CC(=O)CC1(C)C","kingdom":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000000","name":"Organic compounds","chemont_id":"CHEMONTID:0000000","description":"Compounds that contain at least one carbon atom, excluding isocyanide/cyanide and their non-hydrocarbyl derivatives, thiophosgene, carbon diselenide, carbon monosulfide, carbon disulfide, carbon subsulfide, carbon monoxide, carbon dioxide, Carbon suboxide, and dicarbon monoxide."},"inchikey":"InChIKey=GTBHBFNWPIAUKN-UHFFFAOYSA-N","subclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001286","name":"Benzenediols","chemont_id":"CHEMONTID:0001286","description":"Organic compounds containing two hydroxyl groups attached to a benzene ring."},"ancestors":["1-hydroxy-2-unsubstituted benzenoids","Benzene and substituted derivatives","Benzenediols","Benzenoids","Carbonyl compounds","Chemical entities","Cresols","Cyclic ketones","Hydrocarbon derivatives","Hydroquinones","Ketones","Meta cresols","Organic compounds","Organic oxides","Organic oxygen compounds","Organooxygen compounds","Ortho cresols","Phenols","Toluenes"],"superclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0002448","name":"Benzenoids","chemont_id":"CHEMONTID:0002448","description":"Aromatic compounds containing one or more benzene rings."},"description":"This compound belongs to the class of organic compounds known as hydroquinones. 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