{"id":8134,"npaid":"NPA008134","original_name":"Rhodochelin","mol_formula":"C23H33N5O12","mol_weight":"571.5400","exact_mass":"571.2126","inchikey":"JFONHXNWLVUYOJ-XGSMPJOYSA-N","smiles":"CC([C@@H](C(=O)N[C@@H](CCCN(C=O)O)C(=O)O)NC(=O)C1=C(C(=CC=C1)O)O)OC(=O)[C@H](CCCN(C=O)O)N","cluster_id":3522,"node_id":2655,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C23H33N5O12/c1-13(40-23(37)15(24)6-3-9-27(38)11-29)18(26-20(33)14-5-2-8-17(31)19(14)32)21(34)25-16(22(35)36)7-4-10-28(39)12-30/h2,5,8,11-13,15-16,18,31-32,38-39H,3-4,6-7,9-10,24H2,1H3,(H,25,34)(H,26,33)(H,35,36)/t13?,15-,16-,18-/m0/s1","m_plus_h":"572.2199","m_plus_na":"594.2018","origin_reference":{"doi":"10.1021/ja1109453","pmid":21381663,"authors":"Bosello, Mattia; Robbel, Lars; Linne, Uwe; Xie, Xiulan; Marahiel, Mohamed A.","title":"Biosynthesis of the siderophore rhodochelin requires the coordinated expression of three independent gene clusters in Rhodococcus jostii RHA1","journal":"Journal of the American Chemical Society","year":2011,"volume":"133","issue":"12","pages":"4587-4595"},"origin_organism":{"id":3582,"type":"Bacterium","genus":"Rhodococcus","species":"jostii RHA1","taxon":{"id":317,"name":"Rhodococcus","rank":"genus","taxon_db":"lpsn","external_id":"516476","ncbi_id":1827,"ancestors":[{"id":1,"name":"Bacteria","rank":"domain","taxon_db":"lpsn","external_id":"0","ncbi_id":2},{"id":203,"name":"Actinobacteria","rank":"phylum","taxon_db":"lpsn","external_id":"0","ncbi_id":201174},{"id":204,"name":"Actinobacteria","rank":"class","taxon_db":"lpsn","external_id":"0","ncbi_id":null},{"id":306,"name":"Corynebacteriales","rank":"order","taxon_db":"lpsn","external_id":"0","ncbi_id":85007},{"id":315,"name":"Nocardiaceae","rank":"family","taxon_db":"lpsn","external_id":"0","ncbi_id":85025}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1021/ja1109453","structure_smiles":"CC([C@@H](C(=O)N[C@@H](CCCN(C=O)O)C(=O)O)NC(=O)C1=C(C(=CC=C1)O)O)OC(=O)[C@H](CCCN(C=O)O)N","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"mibig","external_db_code":"BGC0000417"},{"external_db_name":"npmrd","external_db_code":"NP0009805"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001813","name":"Peptidomimetics","chemont_id":"CHEMONTID:0001813","description":"Compounds 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