{"id":12758,"npaid":"NPA012758","original_name":"Suncheonoside B","mol_formula":"C20H30O7S","mol_weight":"414.5200","exact_mass":"414.1712","inchikey":"CMVHZNYTKJFYLM-WAPRPUHNSA-N","smiles":"C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(C(=C(C(=C2C(=O)SC)C(C)C)C)OC)C)O)O)O","cluster_id":4748,"node_id":3447,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C20H30O7S/c1-8(2)12-9(3)17(25-6)10(4)18(13(12)19(24)28-7)27-20-16(23)15(22)14(21)11(5)26-20/h8,11,14-16,20-23H,1-7H3/t11-,14-,15+,16+,20-/m0/s1","m_plus_h":"415.1785","m_plus_na":"437.1604","origin_reference":{"doi":"10.1021/acs.jnatprod.5b00284","pmid":26078114,"authors":"Shin, Bora; Ahn, Seyeon; Noh, Minsoo; Shin, Jongheon; Oh, Dong-Chan","title":"Suncheonosides A-D, Benzothioate Glycosides from a Marine-Derived Streptomyces sp","journal":"Journal of Natural Products","year":2015,"volume":"78","issue":"6","pages":"1390-1396"},"origin_organism":{"id":3898,"type":"Bacterium","genus":"Streptomyces","species":"sp.","taxon":{"id":283,"name":"Streptomyces","rank":"genus","taxon_db":"lpsn","external_id":"517119","ncbi_id":1883,"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":275,"name":"Streptomycetales","rank":"order","taxon_db":"lpsn","external_id":"0","ncbi_id":85011},{"id":276,"name":"Streptomycetaceae","rank":"family","taxon_db":"lpsn","external_id":"0","ncbi_id":2062}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1021/acs.jnatprod.5b00284","structure_smiles":"C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(C(=C(C(=C2C(=O)SC)C(C)C)C)OC)C)O)O)O","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"npmrd","external_db_code":"NP0014287"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000323","name":"Organooxygen compounds","chemont_id":"CHEMONTID:0000323","description":"Organic compounds containing a bond between a carbon atom and an oxygen atom."},"smiles":"COc1c(C)c(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)c(C(=O)SC)c(C(C)C)c1C","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=CMVHZNYTKJFYLM-WAPRPUHNSA-N","subclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000011","name":"Carbohydrates and carbohydrate conjugates","chemont_id":"CHEMONTID:0000011","description":"Monosaccharides, disaccharides, oligosaccharides, polysaccharides, and their derivatives."},"ancestors":["Acetals","Alcohols and polyols","Alkyl aryl ethers","Anisoles","Aromatic monoterpenoids","Benzene and substituted derivatives","Benzenoids","Benzoic acids and derivatives","Benzoyl derivatives","Carbohydrates and carbohydrate conjugates","Carbothioic S-esters","Carboxylic acids and derivatives","Chemical entities","Cumenes","Ethers","Glycosyl compounds","Hexoses","Hydrocarbon derivatives","Lipids and lipid-like molecules","Methoxybenzenes","Monocyclic monoterpenoids","Monosaccharides","Monoterpenoids","O-glycosyl compounds","Organic acids and derivatives","Organic compounds","Organic oxides","Organic oxygen compounds","Organoheterocyclic compounds","Organooxygen compounds","Organosulfur compounds","Oxacyclic compounds","Oxanes","Phenol ethers","Phenolic glycosides","Phenoxy compounds","Phenylpropanes","Polyols","Prenol lipids","Secondary alcohols","Sulfenyl compounds","Thiobenzoic acids and derivatives","Thiocarboxylic acids and derivatives","Thioesters","Xylenes","m-Xylenes"],"superclass":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0004603","name":"Organic oxygen compounds","chemont_id":"CHEMONTID:0004603","description":"Organic compounds that contain one or more oxygen atoms."},"description":"This compound belongs to the class of organic compounds known as phenolic glycosides. 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