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Antibiotics","year":1980,"volume":"33","issue":"3","pages":"334-336"},"origin_organism":{"id":406,"type":"Fungus","genus":"Aspergillus","species":"terreus","taxon":{"id":1237,"name":"Aspergillus","rank":"genus","taxon_db":"mycobank","external_id":"7248","ncbi_id":5052,"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":617,"name":"Ascomycota","rank":"phylum","taxon_db":"mycobank","external_id":"90031","ncbi_id":4890},{"id":1212,"name":"Eurotiomycetes","rank":"class","taxon_db":"mycobank","external_id":"501483","ncbi_id":147545},{"id":1235,"name":"Eurotiales","rank":"order","taxon_db":"mycobank","external_id":"90472","ncbi_id":5042},{"id":1236,"name":"Aspergillaceae","rank":"family","taxon_db":"mycobank","external_id":"80489","ncbi_id":1131492}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.7164/antibiotics.33.334","structure_smiles":"CC[C@@H](C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O)C","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"mibig","external_db_code":"BGC0000088"},{"external_db_name":"mibig","external_db_code":"BGC0000098"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004693619%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004693620%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004693621%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000839194%3%lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00005435663%3%Lovatatin&"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00005435664%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00005435666%3%Lovastatin&related&molecule&observed&in&standard"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00005435692%3%Lovastatin&related&ion&M+H&;&Mevinolin&annotated&in&standard"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00005435737%3%Lovastatin&M+H;&Mevinolin&annotated&in&standard"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00005435738%3%Lovastatin&M+NH4;&Mevinolin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00005435739%3%Lovastatin&M+Na;&Mevinolin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000078412%1%Lovastatin&(Mevacor)"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000078413%1%Lovastatin&(Mevacor)"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000084933%1%MLS000069585-01!"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000565954%3%MoNA:687075&MLS000069585-01!&M+H"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000566315%3%MoNA:686183&(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl&(2S)-2-methylbutanoate"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000566324%3%MoNA:692558&(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl&(2S)-2-methylbutanoate"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000566328%3%MoNA:686695&(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl&(2S)-2-methylbutanoate"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000566893%3%MoNA:692479&(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl&(2S)-2-methylbutanoate"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000566920%3%MoNA:687075&(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl&(2S)-2-methylbutanoate"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00000566933%3%MoNA:693451&(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl&(2S)-2-methylbutanoate"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004685876%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004685877%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004689947%3%LOVASTATIN"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004689948%3%LOVASTATIN"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004693614%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004693615%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004693616%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004693617%3%Lovastatin"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004694520%3%LOVASTATIN"},{"external_db_name":"gnps","external_db_code":"CCMSLIB00004694521%3%LOVASTATIN"},{"external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oxides","Organic oxygen compounds","Organoheterocyclic compounds","Organooxygen compounds","Oxacyclic compounds","Oxanes","Secondary alcohols"],"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 delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety.","substituents":["Delta valerolactone","Fatty acid ester","Delta_valerolactone","Dicarboxylic acid or derivatives","Oxane","Fatty acyl","Carboxylic acid ester","Secondary alcohol","Carboxylic acid derivative","Oxacycle","Organooxygen compound","Hydrocarbon derivative","Organic oxide","Alcohol","Organic oxygen compound","Carbonyl group","Aliphatic heteropolycyclic compound"],"direct_parent":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001244","name":"Delta valerolactones","chemont_id":"CHEMONTID:0001244","description":"Cyclic organic compounds containing an oxan-2- one moiety."},"intermediate_nodes":[],"alternative_parents":[{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000324","name":"Fatty acid esters","chemont_id":"CHEMONTID:0000324","description":"Carboxylic ester derivatives of a fatty acid."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0002012","name":"Oxanes","chemont_id":"CHEMONTID:0002012","description":"Compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000346","name":"Dicarboxylic acids and derivatives","chemont_id":"CHEMONTID:0000346","description":"Organic compounds containing exactly two carboxylic acid groups."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001661","name":"Secondary alcohols","chemont_id":"CHEMONTID:0001661","description":"Compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl)."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001238","name":"Carboxylic acid esters","chemont_id":"CHEMONTID:0001238","description":"Carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group)."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0004140","name":"Oxacyclic compounds","chemont_id":"CHEMONTID:0004140","description":"Organic compounds containing an heterocycle with at least one oxygen atom linked to a ring carbon."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0003940","name":"Organic oxides","chemont_id":"CHEMONTID:0003940","description":"Organic compounds containing an oxide group."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0004150","name":"Hydrocarbon derivatives","chemont_id":"CHEMONTID:0004150","description":"Derivatives of hydrocarbons obtained by substituting one or more carbon atoms by an heteroatom. They contain at least one carbon atom and heteroatom."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001831","name":"Carbonyl compounds","chemont_id":"CHEMONTID:0001831","description":"Organic compounds containing a carbonyl group, with the general structure RC(=O)R', where R=organyl, R'=H, N, O, organyl group or halide group."}],"molecular_framework":"Aliphatic heteropolycyclic compounds","external_descriptors":[],"predicted_chebi_terms":["fatty acid ester (CHEBI:35748)","oxanes (CHEBI:46942)","dicarboxylic acid (CHEBI:35692)","secondary alcohol (CHEBI:35681)","carboxylic ester (CHEBI:33308)","oxacycle (CHEBI:38104)","organic oxide (CHEBI:25701)","organic molecule (CHEBI:72695)","carbonyl compound (CHEBI:36586)","delta-lactone (CHEBI:18946)","chemical entity (CHEBI:24431)","lipid (CHEBI:18059)","organooxygen compound (CHEBI:36963)","organic heterocyclic compound (CHEBI:24532)","organic acid (CHEBI:64709)","carboxylic acid (CHEBI:33575)","oxygen molecular entity (CHEBI:25806)","organic molecular entity (CHEBI:50860)","polyol (CHEBI:26191)","organic hydroxy compound (CHEBI:33822)","alcohol (CHEBI:30879)","lactone (CHEBI:25000)"],"classification_version":"2.1","predicted_lipidmaps_terms":["Fatty esters (FA07)","Dicarboxylic acids (FA0117)","Fatty Acyls (FA)"]},"npclassifier":{"isglycoside":false,"class_results":["Monacolins and Monacolin derivatives"],"pathway_results":["Polyketides"],"superclass_results":["Cyclic polyketides"]}}