Quinolines and derivatives

Quinolines and derivatives
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Thermo Scientific Alfa Aesar Quinine hemisulfate monohydrate, 98+%
CAS: 6119-70-6 Molecular Formula: C40H54N4O10S Molecular Weight (g/mol): 782.95 MDL Number: MFCD00150790 InChI Key: ZHNFLHYOFXQIOW-OIGVVMIYNA-N Synonym: Quinine sulfate (2:1) (salt) dihydrate; Quinine sulfate dihydrate PubChem CID: 134129495 IUPAC Name: (R)-[(2R,4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;sulfuric acid;tetrahydrate SMILES: O.O.OS(O)(=O)=O.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C
PubChem CID | 134129495 |
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CAS | 6119-70-6 |
Molecular Weight (g/mol) | 782.95 |
MDL Number | MFCD00150790 |
SMILES | O.O.OS(O)(=O)=O.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C |
Synonym | Quinine sulfate (2:1) (salt) dihydrate; Quinine sulfate dihydrate |
IUPAC Name | (R)-[(2R,4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;sulfuric acid;tetrahydrate |
InChI Key | ZHNFLHYOFXQIOW-OIGVVMIYNA-N |
Molecular Formula | C40H54N4O10S |
Thermo Scientific Acros Quinine, 98+%, anhydrous
CAS: 130-95-0 Molecular Formula: C20H24N2O2 Molecular Weight (g/mol): 324.42 MDL Number: MFCD00198096 InChI Key: LOUPRKONTZGTKE-ZCXAXGJJNA-N Synonym: 1r-6-methoxyquinolin-4-yl 1s,4s,5r-5-vinylquinuclidin-2-yl methanol,quinine anhydrous,+-2,3-o-isopropylidene-l-threitol PubChem CID: 129316724 IUPAC Name: (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-[6-(trideuteriomethoxy)quinolin-4-yl]methanol SMILES: [H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C
PubChem CID | 129316724 |
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CAS | 130-95-0 |
Molecular Weight (g/mol) | 324.42 |
MDL Number | MFCD00198096 |
SMILES | [H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C |
Synonym | 1r-6-methoxyquinolin-4-yl 1s,4s,5r-5-vinylquinuclidin-2-yl methanol,quinine anhydrous,+-2,3-o-isopropylidene-l-threitol |
IUPAC Name | (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-[6-(trideuteriomethoxy)quinolin-4-yl]methanol |
InChI Key | LOUPRKONTZGTKE-ZCXAXGJJNA-N |
Molecular Formula | C20H24N2O2 |
Tocris Saquinavir mesylate, Tocris Bioscience™
CAS: 149845-06-7 Molecular Formula: C39H54N6O8S Molecular Weight (g/mol): 766.955 InChI Key: IRHXGOXEBNJUSN-YOXDLBRISA-N Synonym: saquinavir mesylate,invirase,fortovase,saquinavir mesilate,saquinavir, mesylate,unii-uhb9z3841a,saquinavir monomethanesulfonate salt,saquinavir mesylate aids initiative,invirase tn,dsstox_cid_3835 PubChem CID: 60934 ChEBI: CHEBI:32121 IUPAC Name: (2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide;methanesulfonic acid SMILES: CC(C)(C)NC(=O)C1CC2CCCCC2CN1CC(C(CC3=CC=CC=C3)NC(=O)C(CC(=O)N)NC(=O)C4=NC5=CC=CC=C5C=C4)O.CS(=O)(=O)O
PubChem CID | 60934 |
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CAS | 149845-06-7 |
Molecular Weight (g/mol) | 766.955 |
ChEBI | CHEBI:32121 |
SMILES | CC(C)(C)NC(=O)C1CC2CCCCC2CN1CC(C(CC3=CC=CC=C3)NC(=O)C(CC(=O)N)NC(=O)C4=NC5=CC=CC=C5C=C4)O.CS(=O)(=O)O |
Synonym | saquinavir mesylate,invirase,fortovase,saquinavir mesilate,saquinavir, mesylate,unii-uhb9z3841a,saquinavir monomethanesulfonate salt,saquinavir mesylate aids initiative,invirase tn,dsstox_cid_3835 |
IUPAC Name | (2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide;methanesulfonic acid |
InChI Key | IRHXGOXEBNJUSN-YOXDLBRISA-N |
Molecular Formula | C39H54N6O8S |
Thermo Scientific Chemicals Quinine sulfate dihydrate, 99+%
CAS: 6119-70-6 Molecular Formula: C40H54N4O10S Molecular Weight (g/mol): 782.95 MDL Number: MFCD00150790 InChI Key: ZHNFLHYOFXQIOW-OIGVVMIYNA-N PubChem CID: 134129495 IUPAC Name: (R)-[(2R,4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;sulfuric acid;tetrahydrate SMILES: O.O.OS(O)(=O)=O.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C
PubChem CID | 134129495 |
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CAS | 6119-70-6 |
Molecular Weight (g/mol) | 782.95 |
MDL Number | MFCD00150790 |
SMILES | O.O.OS(O)(=O)=O.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C.[H][C@@]1(CN2CCC1C[C@@]2([H])[C@H](O)C1=C2C=C(OC)C=CC2=NC=C1)C=C |
IUPAC Name | (R)-[(2R,4R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;sulfuric acid;tetrahydrate |
InChI Key | ZHNFLHYOFXQIOW-OIGVVMIYNA-N |
Molecular Formula | C40H54N4O10S |
Thermo Scientific Acros 8-Hydroxyquinoline, ACS reagent, Thermo Scientific Chemicals
CAS: 148-24-3 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00006807 InChI Key: MCJGNVYPOGVAJF-UHFFFAOYSA-N Synonym: 8-hydroxyquinoline,8-quinolinol,oxyquinoline,oxine,quinophenol,8-quinol,8-oxyquinoline,phenopyridine,oxychinolin,bioquin PubChem CID: 1923 ChEBI: CHEBI:48981 IUPAC Name: quinolin-8-ol SMILES: OC1=C2N=CC=CC2=CC=C1
PubChem CID | 1923 |
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CAS | 148-24-3 |
Molecular Weight (g/mol) | 145.16 |
ChEBI | CHEBI:48981 |
MDL Number | MFCD00006807 |
SMILES | OC1=C2N=CC=CC2=CC=C1 |
Synonym | 8-hydroxyquinoline,8-quinolinol,oxyquinoline,oxine,quinophenol,8-quinol,8-oxyquinoline,phenopyridine,oxychinolin,bioquin |
IUPAC Name | quinolin-8-ol |
InChI Key | MCJGNVYPOGVAJF-UHFFFAOYSA-N |
Molecular Formula | C9H7NO |
Thermo Scientific Alfa Aesar 8-Hydroxyquinoline, 99%
CAS: 148-24-3 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00006807 InChI Key: MCJGNVYPOGVAJF-UHFFFAOYSA-N Synonym: 8-hydroxyquinoline,8-quinolinol,oxyquinoline,oxine,quinophenol,8-quinol,8-oxyquinoline,phenopyridine,oxychinolin,bioquin PubChem CID: 1923 ChEBI: CHEBI:48981 IUPAC Name: quinolin-8-ol SMILES: OC1=C2N=CC=CC2=CC=C1
PubChem CID | 1923 |
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CAS | 148-24-3 |
Molecular Weight (g/mol) | 145.16 |
ChEBI | CHEBI:48981 |
MDL Number | MFCD00006807 |
SMILES | OC1=C2N=CC=CC2=CC=C1 |
Synonym | 8-hydroxyquinoline,8-quinolinol,oxyquinoline,oxine,quinophenol,8-quinol,8-oxyquinoline,phenopyridine,oxychinolin,bioquin |
IUPAC Name | quinolin-8-ol |
InChI Key | MCJGNVYPOGVAJF-UHFFFAOYSA-N |
Molecular Formula | C9H7NO |
Thermo Scientific Chemicals Ciprofloxacin, 98%
CAS: 85721-33-1 Molecular Formula: C17H18FN3O3 Molecular Weight (g/mol): 331.34 InChI Key: MYSWGUAQZAJSOK-UHFFFAOYSA-N Synonym: ciprofloxacin,ciprofloxacine,ciprobay,ciproxan,ciprofloxacina,cipro,ciprofloxacino,ciprofloxacinum,cipro iv,bacquinor PubChem CID: 2764 ChEBI: CHEBI:100241 IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid SMILES: C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCNCC4)F)C(=O)O
PubChem CID | 2764 |
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CAS | 85721-33-1 |
Molecular Weight (g/mol) | 331.34 |
ChEBI | CHEBI:100241 |
SMILES | C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCNCC4)F)C(=O)O |
Synonym | ciprofloxacin,ciprofloxacine,ciprobay,ciproxan,ciprofloxacina,cipro,ciprofloxacino,ciprofloxacinum,cipro iv,bacquinor |
IUPAC Name | 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid |
InChI Key | MYSWGUAQZAJSOK-UHFFFAOYSA-N |
Molecular Formula | C17H18FN3O3 |
Thermo Scientific Chemicals Cinchonidine, 98.5-101%
CAS: 485-71-2 Molecular Formula: C19H22N2O Molecular Weight (g/mol): 294.40 MDL Number: MFCD00006783 InChI Key: KMPWYEUPVWOPIM-UHFFFAOYNA-N Synonym: cinchonidine PubChem CID: 45358337 IUPAC Name: [(2R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol SMILES: OC(C1CC2CCN1CC2C=C)C1=C2C=CC=CC2=NC=C1
PubChem CID | 45358337 |
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CAS | 485-71-2 |
Molecular Weight (g/mol) | 294.40 |
MDL Number | MFCD00006783 |
SMILES | OC(C1CC2CCN1CC2C=C)C1=C2C=CC=CC2=NC=C1 |
Synonym | cinchonidine |
IUPAC Name | [(2R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol |
InChI Key | KMPWYEUPVWOPIM-UHFFFAOYNA-N |
Molecular Formula | C19H22N2O |
Thermo Scientific Acros Dimidium bromide, 98%
CAS: 518-67-2 Molecular Formula: C20H18BrN3 Molecular Weight (g/mol): 380.29 MDL Number: MFCD00011757 InChI Key: MQOKYEROIFEEBH-UHFFFAOYSA-N Synonym: dimidium bromide,trypadine,3,8-diamino-5-methyl-6-phenylphenanthridinium bromide,phenanthridinium 1553,phenanthridinium compound 1553,phenanthridinium, 3,8-diamino-5-methyl-6-phenyl-, bromide,2,7-diamino-10-methyl-9-phenylphenanthridinium bromide,3,8-diamino-5-methyl-6-phenylphenanthridin-5-ium bromide,phenanthridium 1553 PubChem CID: 68207 IUPAC Name: 5-methyl-6-phenylphenanthridin-5-ium-3,8-diamine;bromide SMILES: [Br-].C[N+]1=C(C2=CC=CC=C2)C2=CC(N)=CC=C2C2=CC=C(N)C=C12
PubChem CID | 68207 |
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CAS | 518-67-2 |
Molecular Weight (g/mol) | 380.29 |
MDL Number | MFCD00011757 |
SMILES | [Br-].C[N+]1=C(C2=CC=CC=C2)C2=CC(N)=CC=C2C2=CC=C(N)C=C12 |
Synonym | dimidium bromide,trypadine,3,8-diamino-5-methyl-6-phenylphenanthridinium bromide,phenanthridinium 1553,phenanthridinium compound 1553,phenanthridinium, 3,8-diamino-5-methyl-6-phenyl-, bromide,2,7-diamino-10-methyl-9-phenylphenanthridinium bromide,3,8-diamino-5-methyl-6-phenylphenanthridin-5-ium bromide,phenanthridium 1553 |
IUPAC Name | 5-methyl-6-phenylphenanthridin-5-ium-3,8-diamine;bromide |
InChI Key | MQOKYEROIFEEBH-UHFFFAOYSA-N |
Molecular Formula | C20H18BrN3 |
Thermo Scientific Acros 4-Hydroxyquinoline, 98%
CAS: 611-36-9 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00006777,MFCD00956391 InChI Key: PMZDQRJGMBOQBF-UHFFFAOYSA-N Synonym: 4-hydroxyquinoline,quinolin-4-ol,4-quinolinol,quinolin-4 1h-one,4 1h-quinolinone,kynurine,4-hydroxy quinoline,quinoline, 4-hydroxy,ccris 4329,4-chinolinol PubChem CID: 69141 ChEBI: CHEBI:15815 IUPAC Name: 1H-quinolin-4-one SMILES: O=C1C=CNC2=CC=CC=C12
PubChem CID | 69141 |
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CAS | 611-36-9 |
Molecular Weight (g/mol) | 145.16 |
ChEBI | CHEBI:15815 |
MDL Number | MFCD00006777,MFCD00956391 |
SMILES | O=C1C=CNC2=CC=CC=C12 |
Synonym | 4-hydroxyquinoline,quinolin-4-ol,4-quinolinol,quinolin-4 1h-one,4 1h-quinolinone,kynurine,4-hydroxy quinoline,quinoline, 4-hydroxy,ccris 4329,4-chinolinol |
IUPAC Name | 1H-quinolin-4-one |
InChI Key | PMZDQRJGMBOQBF-UHFFFAOYSA-N |
Molecular Formula | C9H7NO |
Thermo Scientific Alfa Aesar 4-Hydroxyquinoline-2-carboxylic acid hydrate, 98%
CAS: 345909-35-5 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD00149476 InChI Key: HCZHHEIFKROPDY-UHFFFAOYSA-N Synonym: 4-hydroxyquinoline-2-carboxylic acid hydrate,kynurenic acid hydrate,kynurenic acid monohydrate,4-hydroxyquinaldic acid hydrate,c10h7no3.h2o,2-carboxy-4-hydroxyquinoline hydrate,4-hydroxyquinoline-2-carboxylic acid, hydrate,4-hydroxyquinoline-2-carboxylic acid,hydrate,98,4-hydroxy-2-quinolinecarboxylic acid hydrate 1:1 PubChem CID: 18530299 SMILES: OC(=O)C1=NC2=CC=CC=C2C(O)=C1
PubChem CID | 18530299 |
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CAS | 345909-35-5 |
Molecular Weight (g/mol) | 189.17 |
MDL Number | MFCD00149476 |
SMILES | OC(=O)C1=NC2=CC=CC=C2C(O)=C1 |
Synonym | 4-hydroxyquinoline-2-carboxylic acid hydrate,kynurenic acid hydrate,kynurenic acid monohydrate,4-hydroxyquinaldic acid hydrate,c10h7no3.h2o,2-carboxy-4-hydroxyquinoline hydrate,4-hydroxyquinoline-2-carboxylic acid, hydrate,4-hydroxyquinoline-2-carboxylic acid,hydrate,98,4-hydroxy-2-quinolinecarboxylic acid hydrate 1:1 |
InChI Key | HCZHHEIFKROPDY-UHFFFAOYSA-N |
Molecular Formula | C10H7NO3 |
Thermo Scientific Alfa Aesar 2-Amino-4-hydroxyquinoline hydrate, 97%, water <12%
CAS: 42712-64-1 Molecular Formula: C9H8N2O Molecular Weight (g/mol): 160.18 MDL Number: MFCD00052386 InChI Key: LWGUCIXHBVVATR-UHFFFAOYSA-N Synonym: 2-aminoquinolin-4-ol,4-quinolinol, 2-amino,2-amino-4-hydroxyquinoline,2-aminoquinolin-4 1h-one,2-amino-4-1h-quinolinone,2-amino-quinolin-4-ol,2-amino-4 1h-quinolinone,4 1h-quinolinone, 2-amino,2-?aminoquinolin-?4-?ol,aminoquinolinol PubChem CID: 594793 IUPAC Name: 2-amino-1H-quinolin-4-one SMILES: NC1=CC(=O)C2=CC=CC=C2N1
PubChem CID | 594793 |
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CAS | 42712-64-1 |
Molecular Weight (g/mol) | 160.18 |
MDL Number | MFCD00052386 |
SMILES | NC1=CC(=O)C2=CC=CC=C2N1 |
Synonym | 2-aminoquinolin-4-ol,4-quinolinol, 2-amino,2-amino-4-hydroxyquinoline,2-aminoquinolin-4 1h-one,2-amino-4-1h-quinolinone,2-amino-quinolin-4-ol,2-amino-4 1h-quinolinone,4 1h-quinolinone, 2-amino,2-?aminoquinolin-?4-?ol,aminoquinolinol |
IUPAC Name | 2-amino-1H-quinolin-4-one |
InChI Key | LWGUCIXHBVVATR-UHFFFAOYSA-N |
Molecular Formula | C9H8N2O |