{"id":16381,"npaid":"NPA016381","original_name":"Phelliribsin A","mol_formula":"C22H16O7","mol_weight":"392.3630","exact_mass":"392.0896","inchikey":"HCUSHIWVGLUDLU-DUXPYHPUSA-N","smiles":"CC(=O)C1=CC2=CC(=C(C=C2C13C(=O)C=C(O3)/C=C/C4=CC(=C(C=C4)O)O)O)O","cluster_id":5602,"node_id":3965,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C22H16O7/c1-11(23)15-7-13-8-19(26)20(27)10-16(13)22(15)21(28)9-14(29-22)4-2-12-3-5-17(24)18(25)6-12/h2-10,24-27H,1H3/b4-2+","m_plus_h":"393.0969","m_plus_na":"415.0788","origin_reference":{"doi":"10.1248/cpb.c13-00722","pmid":24390502,"authors":"Kubo, Miwa; Liu, Yuhong; Ishida, Mami; Harada, Kenichi; Fukuyama, Yoshiyasu","title":"A new spiroindene pigment from the medicinal fungus Phellinus ribis","journal":"Chemical and Pharmaceutical Bulletin","year":2014,"volume":"62","issue":"1","pages":"122-124"},"origin_organism":{"id":1500,"type":"Fungus","genus":"Phellinus","species":"ribis","taxon":{"id":1637,"name":"Phellinus","rank":"genus","taxon_db":"mycobank","external_id":"18246","ncbi_id":40470,"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":1632,"name":"Hymenochaetales","rank":"order","taxon_db":"mycobank","external_id":"90548","ncbi_id":139380},{"id":1633,"name":"Hymenochaetaceae","rank":"family","taxon_db":"mycobank","external_id":"536196","ncbi_id":40424}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1248/cpb.c13-00722","structure_smiles":"CC(=O)C1=CC2=CC(=C(C=C2C13C(=O)C=C(O3)/C=C/C4=CC(=C(C=C4)O)O)O)O","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"npmrd","external_db_code":"NP0012392"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000021","name":"Indenes and isoindenes","chemont_id":"CHEMONTID:0000021","description":"Compounds containing an indene moiety(which consists of a cyclopentadiene fused to a benzene ring), or a isoindene moiety (which consists of a cyclopentadiene fused to cyclohexadiene ring)."},"smiles":"CC(=O)C1=CC2=CC(O)=C(O)C=C2C11OC(\\C=C\\C2=CC(O)=C(O)C=C2)=CC1=O","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=HCUSHIWVGLUDLU-DUXPYHPUSA-N","subclass":null,"ancestors":["1-hydroxy-2-unsubstituted benzenoids","1-hydroxy-4-unsubstituted benzenoids","Benzene and substituted derivatives","Benzenediols","Benzenoids","Carbonyl compounds","Catechols","Chemical entities","Dihydrofurans","Furanones","Hydrocarbon derivatives","Indenes and isoindenes","Ketones","Organic acids and derivatives","Organic compounds","Organic oxides","Organic oxygen compounds","Organoheterocyclic compounds","Organooxygen compounds","Oxacyclic compounds","Phenols","Styrenes","Vinylogous esters"],"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 indenes and isoindenes. 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