{"id":33309,"npaid":"NPA033309","original_name":"Cyanochelin A","mol_formula":"C35H52N6O14","mol_weight":"780.8290","exact_mass":"780.3542","inchikey":"JJPKARAEIBOESM-UHFFFAOYSA-N","smiles":"CCCCCCCCCCCC1=C(C2=NC(C(=O)NCC(=O)NCC(=O)NC(C(=O)NCC(=O)NC(CO)C(O)C(=O)O)C(O)C(=O)O)CO2)C(O)=CC=C1","cluster_id":9589,"node_id":6416,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C35H52N6O14/c1-2-3-4-5-6-7-8-9-10-12-20-13-11-14-23(43)27(20)33-40-22(19-55-33)31(49)37-15-24(44)36-16-26(46)41-28(30(48)35(53)54)32(50)38-17-25(45)39-21(18-42)29(47)34(51)52/h11,13-14,21-22,28-30,42-43,47-48H,2-10,12,15-19H2,1H3,(H,36,44)(H,37,49)(H,38,50)(H,39,45)(H,41,46)(H,51,52)(H,53,54)","m_plus_h":"781.3615","m_plus_na":"803.3434","origin_reference":{"doi":"10.1128/AEM.03128-20","pmid":34132591,"authors":"Galica, Tomáš; Borbone, Nicola; Mareš, Jan; Kust, Andreja; Caso, Alessia; Esposito, Germana; Saurav, Kumar; Hájek, Jan; Řeháková, Klára; Urajová, Petra; Costantino, Valeria; Hrouzek, Pavel","title":"Cyanochelins, an Overlooked Class of Widely Distributed Cyanobacterial Siderophores, Discovered by Silent Gene Cluster Awakening.","journal":"Applied Environmental Microbiology","year":2021,"volume":"87","issue":"17","pages":"e0312820"},"origin_organism":{"id":10759,"type":"Bacterium","genus":"Rivularia","species":"sp. 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Monosaccharides have the general formula CnH2nOn."},{"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/C0002279","name":"Benzene and substituted derivatives","chemont_id":"CHEMONTID:0002279","description":"Aromatic compounds containing one monocyclic ring system consisting of benzene."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001359","name":"Alpha hydroxy acids and derivatives","chemont_id":"CHEMONTID:0001359","description":"Organic compounds containing a carboxylic acid substituted with a hydroxyl group on the adjacent carbon."},{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000084","name":"Oxazolines","chemont_id":"CHEMONTID:0000084","description":"Organic compounds containing 1,3-oxazoline, a five-membered ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively. 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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."}],"molecular_framework":"Aromatic heteromonocyclic compounds","external_descriptors":[],"predicted_chebi_terms":[],"classification_version":"2.1","predicted_lipidmaps_terms":[]}}