{"id":32803,"npaid":"NPA032803","original_name":"Brasiliamide B","mol_formula":"C24H26N2O5","mol_weight":"422.4810","exact_mass":"422.1842","inchikey":"KOVXJYRERSJPIQ-UHFFFAOYSA-N","smiles":"COC1=CC(CC2=CN(C(C)=O)C(CC3=CC=CC=C3)CN2C(C)=O)=CC2=C1OCO2","cluster_id":3448,"node_id":2606,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C24H26N2O5/c1-16(27)25-14-21(10-19-11-22(29-3)24-23(12-19)30-15-31-24)26(17(2)28)13-20(25)9-18-7-5-4-6-8-18/h4-8,11-12,14,20H,9-10,13,15H2,1-3H3","m_plus_h":"423.1915","m_plus_na":"445.1734","origin_reference":{"doi":"10.1271/bbb.66.1697","pmid":12353630,"authors":"Fujita, Tomoyuki; Makishima, Daisuke; Akiyama, Kohki; Hayashi, Hideo","title":"New convulsive compounds, Brasiliamides A and B, from Penicillium brasilianum Batista JV-379","journal":"Bioscience Biotechnology and Biochemistry","year":2002,"volume":"66","issue":"8","pages":"1697-1705"},"origin_organism":{"id":3836,"type":"Fungus","genus":"Penicillium","species":"brasilianum Batista JV-379","taxon":{"id":1239,"name":"Penicillium","rank":"genus","taxon_db":"mycobank","external_id":"9257","ncbi_id":5073,"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":"10.1271/bbb.66.1697","structure_smiles":"COC1=CC(CC2=CN(C(C)=O)C(CC3=CC=CC=C3)CN2C(C)=O)=CC2=C1OCO2","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"mibig","external_db_code":"BGC0002278"},{"external_db_name":"npmrd","external_db_code":"NP0184267"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000296","name":"Benzodioxoles","chemont_id":"CHEMONTID:0000296","description":"Organic compounds containing a benzene ring fused to either isomers of dioxole. 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