{"id":2110,"npaid":"NPA002110","original_name":"Malevamide B","mol_formula":"C76H124N12O14","mol_weight":"1429.8980","exact_mass":"1428.9360","inchikey":"IJCFPNODXKAIPP-DBABXTLQSA-N","smiles":"CCCC1C(C(=O)O[C@@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N(C(C(=O)N(C(C(=O)N2CCC[C@H]2C(=O)N(C(C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N(C(C(=O)N4CCC[C@H]4C(=O)N([C@H](C(=O)N1)CC5=CC=CC=C5)C)C(C)C)C)[C@@H](C)CC)C(C)C)C)C(C)C)C)C(C)C)C)C(C)C)C)C)C(C)C)C","cluster_id":352,"node_id":317,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C76H124N12O14/c1-24-32-52-49(16)76(101)102-63(47(13)14)75(100)80(18)50(17)64(89)78-57(42(3)4)70(95)84(22)60(44(7)8)72(97)85(23)62(46(11)12)74(99)88-40-31-37-55(88)68(93)82(20)59(43(5)6)66(91)79-58(48(15)25-2)71(96)86-38-29-36-54(86)69(94)83(21)61(45(9)10)73(98)87-39-30-35-53(87)67(92)81(19)56(65(90)77-52)41-51-33-27-26-28-34-51/h26-28,33-34,42-50,52-63H,24-25,29-32,35-41H2,1-23H3,(H,77,90)(H,78,89)(H,79,91)/t48-,49?,50-,52?,53-,54-,55-,56-,57-,58-,59?,60?,61?,62?,63+/m0/s1","m_plus_h":"1429.9433","m_plus_na":"1451.9252","origin_reference":{"doi":"10.1021/np990449+","pmid":10785414,"authors":"Horgen, F. David; Yoshida, Wesley Y.; Scheuer, Paul J.","title":"Malevamides A-C, new depsipeptides from the marine cyanobacterium Symploca laete-viridis","journal":"Journal of Natural Products","year":2000,"volume":"63","issue":"4","pages":"461-467"},"origin_organism":{"id":1447,"type":"Bacterium","genus":"Symploca","species":"laete-viridis","taxon":{"id":488,"name":"Symploca","rank":"genus","taxon_db":"lpsn","external_id":"0","ncbi_id":105591,"ancestors":[{"id":1,"name":"Bacteria","rank":"domain","taxon_db":"lpsn","external_id":"0","ncbi_id":2},{"id":417,"name":"Cyanobacteria","rank":"phylum","taxon_db":"lpsn","external_id":"0","ncbi_id":1117},{"id":418,"name":"Cyanophyceae","rank":"class","taxon_db":"lpsn","external_id":"0","ncbi_id":null},{"id":473,"name":"Oscillatoriales","rank":"order","taxon_db":"lpsn","external_id":"0","ncbi_id":1150},{"id":486,"name":"Microcoleaceae","rank":"family","taxon_db":"lpsn","external_id":"0","ncbi_id":1892252}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1021/np990449+","structure_smiles":"CCCC1C(C(=O)O[C@@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N(C(C(=O)N(C(C(=O)N2CCC[C@H]2C(=O)N(C(C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N(C(C(=O)N4CCC[C@H]4C(=O)N([C@H](C(=O)N1)CC5=CC=CC=C5)C)C(C)C)C)[C@@H](C)CC)C(C)C)C)C(C)C)C)C(C)C)C)C(C)C)C)C)C(C)C)C","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"gnps","external_db_code":"CCMSLIB00000577844%malevamide_B_11150_dereplictor_pv_3.51344e-11%3"},{"external_db_name":"npmrd","external_db_code":"NP0003241"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001813","name":"Peptidomimetics","chemont_id":"CHEMONTID:0001813","description":"Compounds containing non-peptidic structural elements that is capable of mimicking or antagonizing the biological action(s) of a natural parent peptide."},"smiles":"CCCC1NC(=O)[C@H](CC2=CC=CC=C2)N(C)C(=O)[C@@H]2CCCN2C(=O)C(C(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)C(C(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)C(C(C)C)N(C)C(=O)C(C(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)[C@H](OC(=O)C1C)C(C)C)C(C)C)[C@@H](C)CC","kingdom":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000000","name":"Organic compounds","chemont_id":"CHEMONTID:0000000","description":"Compounds that contain at least one carbon atom, excluding isocyanide/cyanide and their non-hydrocarbyl derivatives, thiophosgene, carbon diselenide, carbon monosulfide, carbon disulfide, carbon subsulfide, carbon monoxide, carbon dioxide, Carbon suboxide, and dicarbon monoxide."},"inchikey":"InChIKey=IJCFPNODXKAIPP-DBABXTLQSA-N","subclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0001961","name":"Depsipeptides","chemont_id":"CHEMONTID:0001961","description":"Natural or synthetic compounds having sequences of amino and hydroxy carboxylic acid residues (usually α-amino and α-hydroxy acids), commonly but not necessarily regularly alternating."},"ancestors":["Alpha amino acids and derivatives","Amino acids and derivatives","Amino acids, peptides, and analogues","Azacyclic compounds","Benzene and substituted derivatives","Benzenoids","Carbonyl compounds","Carboxylic acid amides","Carboxylic acid derivatives","Carboxylic acid esters","Carboxylic acids and derivatives","Chemical entities","Cyclic depsipeptides","Depsipeptides","Hydrocarbon derivatives","Lactams","Lactones","Macrolactams","Macrolide lactams","Macrolides and analogues","Monocarboxylic acids and derivatives","Organic acids and derivatives","Organic compounds","Organic nitrogen compounds","Organic oxides","Organic oxygen compounds","Organoheterocyclic compounds","Organonitrogen compounds","Organooxygen compounds","Organopnictogen compounds","Oxacyclic compounds","Peptidomimetics","Phenylpropanoids and polyketides","Pyrrolidines","Secondary carboxylic acid amides","Tertiary carboxylic acid amides"],"superclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000264","name":"Organic acids and derivatives","chemont_id":"CHEMONTID:0000264","description":"Compounds an organic acid or a derivative thereof."},"description":"This compound belongs to the class of organic compounds known as cyclic depsipeptides. 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