{"id":20498,"npaid":"NPA020498","original_name":"Julichrome Q6.6","mol_formula":"C38H38O12","mol_weight":"686.7100","exact_mass":"686.2363","inchikey":"UYEWMDUNNUBCMC-UHFFFAOYSA-N","smiles":"CC(C1C2=C(C(=O)CC1(C)O)C(=C3C(=C2)C=CC(=C3O)C4=C(C5=C(C6=C(C=C5C=C4)C(C(CC6=O)(C)O)C(C)OC(=O)C)O)O)O)OC(=O)C","cluster_id":1472,"node_id":1213,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C38H38O12/c1-15(49-17(3)39)31-23-11-19-7-9-21(33(43)27(19)35(45)29(23)25(41)13-37(31,5)47)22-10-8-20-12-24-30(36(46)28(20)34(22)44)26(42)14-38(6,48)32(24)16(2)50-18(4)40/h7-12,15-16,31-32,43-48H,13-14H2,1-6H3","m_plus_h":"687.2436","m_plus_na":"709.2255","origin_reference":{"doi":"10.1016/s0040-4020(01)98020-2","pmid":null,"authors":"Tsuji, N; Nagashima, K","title":"Studies on julimycins-VII: The structures of julichromes Q1.6, Q6.6 and Q5.6","journal":"Tetrahedron","year":1971,"volume":"27","issue":"7","pages":"1557-1563"},"origin_organism":{"id":1645,"type":"Bacterium","genus":"Streptomyces","species":"shiodaensis","taxon":{"id":283,"name":"Streptomyces","rank":"genus","taxon_db":"lpsn","external_id":"517119","ncbi_id":1883,"ancestors":[{"id":1,"name":"Bacteria","rank":"domain","taxon_db":"lpsn","external_id":"0","ncbi_id":2},{"id":203,"name":"Actinobacteria","rank":"phylum","taxon_db":"lpsn","external_id":"0","ncbi_id":201174},{"id":204,"name":"Actinobacteria","rank":"class","taxon_db":"lpsn","external_id":"0","ncbi_id":null},{"id":275,"name":"Streptomycetales","rank":"order","taxon_db":"lpsn","external_id":"0","ncbi_id":85011},{"id":276,"name":"Streptomycetaceae","rank":"family","taxon_db":"lpsn","external_id":"0","ncbi_id":2062}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1016/s0040-4020(01)98020-2","structure_smiles":"CC(C1C2=C(C(=O)CC1(C)O)C(=C3C(=C2)C=CC(=C3O)C4=C(C5=C(C6=C(C=C5C=C4)C(C(CC6=O)(C)O)C(C)OC(=O)C)O)O)O)OC(=O)C","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"mibig","external_db_code":"BGC0002514"},{"external_db_name":"npmrd","external_db_code":"NP0281746"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000018","name":"Anthracenes","chemont_id":"CHEMONTID:0000018","description":"Organic compounds containing a system of three linearly fused benzene rings."},"smiles":"CC(OC(C)=O)C1c2cc3ccc(c(O)c3c(O)c2C(=O)CC1(C)O)-c1ccc2cc3C(C(C)OC(C)=O)C(C)(O)CC(=O)c3c(O)c2c1O","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=UYEWMDUNNUBCMC-UHFFFAOYSA-N","subclass":null,"ancestors":["1-hydroxy-4-unsubstituted benzenoids","Alcohols and polyols","Anthracenes","Aryl alkyl ketones","Aryl ketones","Benzenoids","Carbonyl compounds","Carboxylic acid derivatives","Carboxylic acid esters","Carboxylic acids and derivatives","Chemical entities","Dicarboxylic acids and derivatives","Hydrocarbon derivatives","Ketones","Naphthalenes","Naphthols and derivatives","Organic acids and derivatives","Organic compounds","Organic oxides","Organic oxygen compounds","Organooxygen compounds","Phenols","Polyols","Tertiary alcohols","Tetralins","Vinylogous acids"],"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 anthracenes. 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