{"id":16272,"npaid":"NPA016272","original_name":"3-hydroxy-2,4-dimethylheptacosyl acetate","mol_formula":"C31H62O3","mol_weight":"482.8340","exact_mass":"482.4699","inchikey":"RYPFOCBQDJKYPW-UHFFFAOYSA-N","smiles":"CCCCCCCCCCCCCCCCCCCCCCCC(C)C(C(C)COC(=O)C)O","cluster_id":5574,"node_id":3945,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C31H62O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28(2)31(33)29(3)27-34-30(4)32/h28-29,31,33H,5-27H2,1-4H3","m_plus_h":"483.4772","m_plus_na":"505.4591","origin_reference":{"doi":"10.1080/14786419.2016.1160237","pmid":26987031,"authors":"Tel-Çayan, Gülsen; Muhammad, Akhtar; Duru, Mehmet Emin; Öztürk, Mehmet; Adhikari, Achyut; Türkoğlu, Aziz","title":"A new fatty acid ester from an edible mushroom Rhizopogon luteolus","journal":"Natural Product Research","year":2016,"volume":"30","issue":"20","pages":"2258-2264"},"origin_organism":{"id":5103,"type":"Fungus","genus":"Rhizopogon","species":"luteolus Fr.","taxon":{"id":1600,"name":"Rhizopogon","rank":"genus","taxon_db":"mycobank","external_id":"19297","ncbi_id":5375,"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":1578,"name":"Boletales","rank":"order","taxon_db":"mycobank","external_id":"90529","ncbi_id":68889},{"id":1599,"name":"Rhizopogonaceae","rank":"family","taxon_db":"mycobank","external_id":"81346","ncbi_id":48595}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1080/14786419.2016.1160237","structure_smiles":"CCCCCCCCCCCCCCCCCCCCCCCC(C)C(C(C)COC(=O)C)O","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"npmrd","external_db_code":"NP0015268"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0003909","name":"Fatty Acyls","chemont_id":"CHEMONTID:0003909","description":"Organic molecules synthesized by chain elongation of an acetyl-CoA primer with malonyl-CoA (or methylmalonyl-CoA) groups that might contain a cyclic functionality and/or are substituted with heteroatoms."},"smiles":"CCCCCCCCCCCCCCCCCCCCCCCC(C)C(O)C(C)COC(C)=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=RYPFOCBQDJKYPW-UHFFFAOYSA-N","subclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001722","name":"Fatty alcohol esters","chemont_id":"CHEMONTID:0001722","description":"Ester derivatives of a fatty alcohol."},"ancestors":["Alcohols and polyols","Carbonyl compounds","Carboxylic acid derivatives","Carboxylic acid esters","Carboxylic acids and derivatives","Chemical entities","Fatty Acyls","Fatty alcohol esters","Fatty alcohols","Hydrocarbon derivatives","Lipids and lipid-like molecules","Monocarboxylic acids and derivatives","Organic acids and derivatives","Organic compounds","Organic oxides","Organic oxygen compounds","Organooxygen compounds","Secondary alcohols"],"superclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000012","name":"Lipids and lipid-like molecules","chemont_id":"CHEMONTID:0000012","description":"Fatty acids and their derivatives, and substances related biosynthetically or functionally to these compounds."},"description":"This compound belongs to the class of organic compounds known as fatty alcohol esters. 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