{"id":28328,"npaid":"NPA028328","original_name":"Guangnanmycin A","mol_formula":"C24H30N2O4S2","mol_weight":"474.6480","exact_mass":"474.1647","inchikey":"SGXOQRJUHWKPDN-UZLHQLAUSA-N","smiles":"C=C1/C=C/C(C)=C\\C2=CSC(=N2)C2(CC2)NC(=O)C[C@](S)(CC(=O)O)CC/C(C)=C/[C@H]1O","cluster_id":8481,"node_id":5744,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C24H30N2O4S2/c1-15-4-5-17(3)19(27)11-16(2)6-7-23(31,13-21(29)30)12-20(28)26-24(8-9-24)22-25-18(10-15)14-32-22/h4-5,10-11,14,19,27,31H,3,6-9,12-13H2,1-2H3,(H,26,28)(H,29,30)/b5-4+,15-10-,16-11+/t19-,23+/m1/s1","m_plus_h":"475.1720","m_plus_na":"497.1539","origin_reference":{"doi":"10.1073/pnas.1716245115","pmid":29229819,"authors":"Pan G; Xu Z; Guo Z; Hindra; Ma M; Yang D; Zhou H; Gansemans Y; Zhu X; Huang Y; Zhao LX; Jiang Y; Cheng J; Van Nieuwerburgh F; Suh JW; Duan Y; Shen B","title":"Discovery of the leinamycin family of natural products by mining actinobacterial genomes.","journal":"Proceedings of the National Academy of Sciences of the United States of America","year":2017,"volume":"114","issue":"52","pages":"E11131-E11140"},"origin_organism":{"id":9852,"type":"Bacterium","genus":"Streptomyces","species":"sp. 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Pnictogens are p-block element atoms that are in the group 15 of the periodic table."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000278","name":"Organonitrogen compounds","chemont_id":"CHEMONTID:0000278","description":"Organic compounds containing a nitrogen atom."},{"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":"Aromatic heteropolycyclic compounds","external_descriptors":[],"predicted_chebi_terms":["organic aromatic compound (CHEBI:33659)","carboximidic acid (CHEBI:48378)","secondary alcohol (CHEBI:35681)","dipolar compound (CHEBI:51151)","carbonyl compound (CHEBI:36586)","carboxylic acid (CHEBI:33575)","carboxylic acid anion (CHEBI:29067)","organonitrogen heterocyclic compound (CHEBI:38101)","alkanethiol (CHEBI:47908)","pnictogen molecular entity (CHEBI:33302)","organic molecular entity (CHEBI:50860)","organonitrogen compound (CHEBI:35352)","organic oxide (CHEBI:25701)","organic molecule (CHEBI:72695)","thiazoles (CHEBI:48901)","chemical entity (CHEBI:24431)","organic heterocyclic compound (CHEBI:24532)","organooxygen compound (CHEBI:36963)","oxygen molecular entity (CHEBI:25806)","polyol (CHEBI:26191)","organic hydroxy compound (CHEBI:33822)","alcohol (CHEBI:30879)","organosulfur compound (CHEBI:33261)","thiol (CHEBI:29256)","nitrogen molecular entity (CHEBI:51143)","azole (CHEBI:68452)"],"classification_version":"2.1","predicted_lipidmaps_terms":[]},"npclassifier":{"isglycoside":false,"class_results":[],"pathway_results":["Amino acids and Peptides"],"superclass_results":[]}}