{"id":411,"npaid":"NPA000411","original_name":"Sanguinone A","mol_formula":"C15H14N4O3","mol_weight":"298.3020","exact_mass":"298.1066","inchikey":"MFSNLWAQZVAYTQ-YUMQZZPRSA-N","smiles":"C1CN2[C@@H](CC3=C4C2=C5[C@H]1NCN=C5C(=C4N=C3)O)C(=O)O","cluster_id":323,"node_id":293,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C15H14N4O3/c20-14-11-9-6(4-16-11)3-8(15(21)22)19-2-1-7-10(13(9)19)12(14)18-5-17-7/h4,7-8,17,20H,1-3,5H2,(H,21,22)/t7-,8-/m0/s1","m_plus_h":"299.1139","m_plus_na":"321.0958","origin_reference":{"doi":"10.1021/np070179s","pmid":17658856,"authors":"Peters, Silke; Spiteller, Peter","title":"Sanguinones A and B, blue pyrroloquinoline alkaloids from the fruiting bodies of the mushroom Mycena sanguinolenta","journal":"Journal of Natural Products","year":2007,"volume":"70","issue":"8","pages":"1274-1277"},"origin_organism":{"id":363,"type":"Fungus","genus":"Mycena","species":"sanguinolenta","taxon":{"id":1477,"name":"Mycena","rank":"genus","taxon_db":"mycobank","external_id":"18084","ncbi_id":41247,"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":1367,"name":"Agaricales","rank":"order","taxon_db":"mycobank","external_id":"90508","ncbi_id":5338},{"id":1476,"name":"Mycenaceae","rank":"family","taxon_db":"mycobank","external_id":"505549","ncbi_id":2024004}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1021/np070179s","structure_smiles":"C1CN2[C@@H](CC3=C4C2=C5[C@H]1NCN=C5C(=C4N=C3)O)C(=O)O","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"npmrd","external_db_code":"NP0007189"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001253","name":"Quinolines and derivatives","chemont_id":"CHEMONTID:0001253","description":"Compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene."},"smiles":"OC(=O)[C@@H]1CC2=C3C(N=C2)=C(O)C2=NCN[C@H]4CCN1C3=C24","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=MFSNLWAQZVAYTQ-YUMQZZPRSA-N","subclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0002552","name":"Quinoline carboxylic acids","chemont_id":"CHEMONTID:0002552","description":"Quinolines in which the quinoline ring system is substituted by a carboxyl group at one or more positions."},"ancestors":["Alpha amino acids","Alpha amino acids and derivatives","Amines","Amino acids","Amino acids and derivatives","Amino acids, peptides, and analogues","Aralkylamines","Azacyclic compounds","Benzenoids","Carbonyl compounds","Carboxylic acids","Carboxylic acids and derivatives","Chemical entities","Dialkylamines","Dialkylarylamines","Hydrocarbon derivatives","Hydroquinolines","Imines","Indoles and derivatives","L-alpha-amino acids","Monocarboxylic acids and derivatives","Organic 1,3-dipolar compounds","Organic acids and derivatives","Organic compounds","Organic nitrogen compounds","Organic oxides","Organic oxygen compounds","Organoheterocyclic compounds","Organonitrogen compounds","Organooxygen compounds","Organopnictogen compounds","Propargyl-type 1,3-dipolar organic compounds","Quinoline carboxylic acids","Quinolines and derivatives","Secondary amines","Tertiary alkylarylamines","Tertiary amines"],"superclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000002","name":"Organoheterocyclic compounds","chemont_id":"CHEMONTID:0000002","description":"Compounds containing a ring with least one carbon atom and one non-carbon atom."},"description":"This compound belongs to the class of organic compounds known as quinoline carboxylic acids. 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