{"id":4483,"npaid":"NPA004483","original_name":"Cryptoporic acid Q","mol_formula":"C25H38O9","mol_weight":"482.5700","exact_mass":"482.2516","inchikey":"YCMMTUWPAORXSO-ASVUTRTRSA-N","smiles":"CC(=O)OC[C@@]1(CCC[C@]2([C@H]1CCC(=C)[C@@H]2CO[C@H]([C@@H](CC(=O)O)C(=O)OC)C(=O)OC)C)C","cluster_id":472,"node_id":423,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C25H38O9/c1-15-8-9-19-24(3,14-34-16(2)26)10-7-11-25(19,4)18(15)13-33-21(23(30)32-6)17(12-20(27)28)22(29)31-5/h17-19,21H,1,7-14H2,2-6H3,(H,27,28)/t17-,18+,19+,21-,24+,25-/m1/s1","m_plus_h":"483.2589","m_plus_na":"505.2408","origin_reference":{"doi":"10.3390/molecules18044181","pmid":23571531,"authors":"Yoshikawa, Kazuko; Koso, Kazuaki; Shimomura, Masumi; Tanaka, Masami; Yamamoto, Hirofumi; Imagawa, Hiroshi; Arihara, Shigenobu; Hashimoto, Toshihiro","title":"Yellow pigments, fomitellanols A and B, and drimane sesquiterpenoids, cryptoporic acids P and Q, from fomitella fraxinea and their inhibitory activity against COX and 5-LO","journal":"Molecules","year":2013,"volume":"18","issue":"4","pages":"4181-4191"},"origin_organism":{"id":1477,"type":"Fungus","genus":"Fomitella","species":"fraxinea (Polyporaceae)","taxon":{"id":1555,"name":"Fomitella","rank":"genus","taxon_db":"mycobank","external_id":"17609","ncbi_id":227964,"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":1511,"name":"Polyporales","rank":"order","taxon_db":"mycobank","external_id":"90565","ncbi_id":5303},{"id":1548,"name":"Polyporaceae","rank":"family","taxon_db":"mycobank","external_id":"81203","ncbi_id":5317}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.3390/molecules18044181","structure_smiles":"CC(=O)OC[C@@]1(CCC[C@]2([C@H]1CCC(=C)[C@@H]2CO[C@H]([C@@H](CC(=O)O)C(=O)OC)C(=O)OC)C)C","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"npmrd","external_db_code":"NP0011678"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000265","name":"Carboxylic acids and derivatives","chemont_id":"CHEMONTID:0000265","description":"Compounds containing a carboxylic acid group with the formula -C(=O)OH or a derivative thereof."},"smiles":"[H][C@](CC(O)=O)(C(=O)OC)[C@@]([H])(OC[C@@]1([H])C(=C)CC[C@@]2([H])[C@](C)(COC(C)=O)CCC[C@]12C)C(=O)OC","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=YCMMTUWPAORXSO-ASVUTRTRSA-N","subclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0002966","name":"Tetracarboxylic acids and derivatives","chemont_id":"CHEMONTID:0002966","description":"Carboxylic acids containing exactly four carboxyl groups."},"ancestors":["Carbohydrates and carbohydrate conjugates","Carbonyl compounds","Carboxylic acid derivatives","Carboxylic acid esters","Carboxylic acids","Carboxylic acids and derivatives","Chemical entities","Dialkyl ethers","Ethers","Fatty Acyls","Fatty acid esters","Hydrocarbon derivatives","Lipids and lipid-like molecules","Methyl esters","Monosaccharides","Organic acids and derivatives","Organic compounds","Organic oxides","Organic oxygen compounds","Organooxygen compounds","Tetracarboxylic acids and derivatives"],"superclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000264","name":"Organic acids and derivatives","chemont_id":"CHEMONTID:0000264","description":"Compounds an organic acid or a derivative thereof."},"description":"This compound belongs to the class of organic compounds known as tetracarboxylic acids and derivatives. 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