{"id":4259,"npaid":"NPA004259","original_name":"Rosamicin","mol_formula":"C31H51NO9","mol_weight":"581.7470","exact_mass":"581.3564","inchikey":"IUPCWCLVECYZRV-JZMZINANSA-N","smiles":"CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)C(=O)/C=C/[C@]2(C)O[C@H]2[C@@H]1C","cluster_id":629,"node_id":559,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C31H51NO9/c1-9-25-20(5)29-31(6,41-29)12-10-23(34)17(2)14-21(11-13-33)28(19(4)24(35)16-26(36)39-25)40-30-27(37)22(32(7)8)15-18(3)38-30/h10,12-13,17-22,24-25,27-30,35,37H,9,11,14-16H2,1-8H3/b12-10+/t17-,18-,19+,20-,21+,22+,24-,25-,27-,28-,29+,30+,31+/m1/s1","m_plus_h":"582.3637","m_plus_na":"604.3456","origin_reference":{"doi":"10.1039/C3972001270A","pmid":null,"authors":"Reimann, H.; Jaret, R. 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