Quinidine
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Formula: C20H24N2O2
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Molecular weight: 324.40
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Smiles: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O
Quinidine
Names
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Mycotoxin name: Quinidine
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First synonym: Quinidine
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Synonyms: quinidine,56-54-2,(+)-Quinidine,Conquinine,Conchinin,Chinidin,Pitayine,Quinidex,beta-Quinine,(8R,9S)-Quinidine,(9S)-6'-Methoxycinchonan-9-ol,Cin-Quin,Kinidin,Conchinine,chinidinum,quinidina,Quiniduran,Chinidine,Cinchonan-9-ol, 6'-methoxy-, (9S)-,(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl](6-methoxyquinolin-4-yl)methanol,UNII-ITX08688JL,Quinaglute,Auriquin,Quinidine sulfate,CHEBI:28593,alpha-(6-Methoxy-4-quinolyl)-5-vinyl-2-quinuclidinemethanol,Quinicardine,CHEMBL1294,Duraquin,Quinact,Quinalan,Quinatime,(1S)-(6-Methoxyquinolin-4-yl)((2R,4S,5R)-5-vinylquinuclidin-2-yl)methanol,ITX08688JL,6-Methoxy-alpha-(5-vinyl-2-quinuclidinyl)-4-quinolinemethanol,QUINIDINE HYDROCHLORIDE,MFCD00135581,beta-Quinidine,(3'.alpha., 9S)-6'-Methoxycinchonan-9-ol,TCMDC-131239,NCI-C56246,(8R,9S)-6'-Methoxycinchonan-9-ol,(R)-(6-methoxyquinolin-4-yl)((3S,4R,7S)-3-vinylquinuclidin-7-yl)methanol,(S)-(6-methoxy-4-quinolyl)-[(2R,4S,5R)-5-vinylquinuclidin-2-yl]methanol,(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol,(S)-[(4S,5R,7R)-5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl]-(6-methoxyquinolin-4-yl)methanol,Chinidin [German],SMR000857275,Quinidine [BAN:NF],Quinindine,CCRIS 672,HSDB 225,(S)-(6-methoxyquinolin-4-yl)((2R,5R)-5-vinylquinuclidin-2-yl)methanol,(S)-(6-methoxyquinolin-4-yl)((1S,2R,4S,5R)-5-vinylquinuclidin-2-yl)methanol,(S)-(6-Methoxy-quinolin-4-yl)-((2R,5R)-5-vinyl-1-aza-bicyclo[2.2.2]oct-2-yl)-methanol,QDN,EINECS 200-279-0,Quinidine, anhydrous,Prestwick3_000280,bmse000511,Epitope ID:141803,SCHEMBL15943,BSPBio_000160,MLS001335913,MLS001335914,MLS002548869,BPBio1_000176,GTPL2342,DTXSID4023549,SCHEMBL17537608,HMS2234L10,HMS3259O09,ACT09863,HY-B1751,ZINC3831405,(9S)-6-Methoxy-alpha-(5-vinyl-2-quinuclidinyl)-4-quinolinemethanol,alpha-(6-Methoxy-4-quinolyl)-5-vinyl-2-quinuclidinemethanol (9S)-,BDBM50121975,AKOS015920101,CCG-256507,CS-7812,DB00908,MCULE-7178915526,NC00478,SDCCGMLS-0066600.P001,NCGC00091231-01,NCGC00091231-02,NCGC00091231-03,NCGC00091231-18,AS-30538,AB00514657,6470-EP1441224A2,6470-EP2272835A1,6470-EP2272844A1,6470-EP2272972A1,6470-EP2272973A1,6470-EP2275411A2,6470-EP2277872A1,6470-EP2305655A2,6470-EP2314576A1,6470-EP2314585A1,AB01562940_01,Q412496,W-109256,BRD-K59632282-052-01-5,BRD-K59632282-052-02-3,BRD-K70799801-311-02-7,Quinidine, crystallized, >=98.0% (dried material, NT),101143-86-6
Identifiers / External links
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CAS: 052-02-3,56-54-2,052-03-1,101143-86-6,052-01-5,311-02-7
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PubChem CID: 441074
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DSS TOX CID: DTXCID70819883
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US FDA (UNII): UNII-ITX08688JL
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Wikidata (wiki): Q412496
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Chemical Entities of Biological Interest (CHEBI): CHEBI:28593
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CompTox Chemicals Dashboard (DTXSID): DTXSID4023549
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SCHEMBL: SCHEMBL17537608,SCHEMBL15943
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TOX21 samples 2:Tox21_111720,Tox21_201110
Structure
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Smiles: COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O
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Isomeric smiles: COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3C[C@@H]4CCN3C[C@@H]4C=C)O
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Inchi: InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19+,20-/m0/s1
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Inchikey: LOUPRKONTZGTKE-LHHVKLHASA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C20H24N2O2
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Molecular weight: 324.40
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Monoisotopic mass: 324.183778013
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Fungi
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Fungi id Species 431 Diaporthe sp. CLF-J