Organoheterocyclic compounds
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Thermo Scientific Chemicals Staurosporine, 1 mg/ml in DMSO, sterile-filtered
CAS: 62996-74-1 Molecular Formula: C28H26N4O3 Molecular Weight (g/mol): 466.541 MDL Number: MFCD00077402 InChI Key: HKSZLNNOFSGOKW-ZYSRIHRCSA-N Synonym: staurosporine,kinome_3629 PubChem CID: 49831000 SMILES: CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)OC
| PubChem CID | 49831000 |
|---|---|
| CAS | 62996-74-1 |
| Molecular Weight (g/mol) | 466.541 |
| MDL Number | MFCD00077402 |
| SMILES | CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)OC |
| Synonym | staurosporine,kinome_3629 |
| InChI Key | HKSZLNNOFSGOKW-ZYSRIHRCSA-N |
| Molecular Formula | C28H26N4O3 |
2,6-Lutidine, 99%
CAS: 108-48-5 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.16 MDL Number: MFCD00006345 InChI Key: OISVCGZHLKNMSJ-UHFFFAOYSA-N Synonym: 2,6-lutidine,lutidine,pyridine, 2,6-dimethyl,2,6-dimethypyridine,alpha,alpha'-lutidine,alpha,alpha'-dimethylpyridine,2,6-dimethyl-pyridine,hsdb 79,unii-15fq5d0t3p,2,6-lutidene PubChem CID: 7937 ChEBI: CHEBI:32548 IUPAC Name: 2,6-dimethylpyridine SMILES: CC1=CC=CC(C)=N1
| PubChem CID | 7937 |
|---|---|
| CAS | 108-48-5 |
| Molecular Weight (g/mol) | 107.16 |
| ChEBI | CHEBI:32548 |
| MDL Number | MFCD00006345 |
| SMILES | CC1=CC=CC(C)=N1 |
| Synonym | 2,6-lutidine,lutidine,pyridine, 2,6-dimethyl,2,6-dimethypyridine,alpha,alpha'-lutidine,alpha,alpha'-dimethylpyridine,2,6-dimethyl-pyridine,hsdb 79,unii-15fq5d0t3p,2,6-lutidene |
| IUPAC Name | 2,6-dimethylpyridine |
| InChI Key | OISVCGZHLKNMSJ-UHFFFAOYSA-N |
| Molecular Formula | C7H9N |
5,6-Dihydro-5-methyluracil, 98+%
CAS: 696-04-8 Molecular Formula: C5H8N2O2 Molecular Weight (g/mol): 128.13 MDL Number: MFCD00023159 InChI Key: NBAKTGXDIBVZOO-UHFFFAOYNA-N Synonym: dihydrothymine,5,6-dihydro-5-methyluracil,5,6-dihydrothymine,5-methyl-5,6-dihydrouracil,hydrouracil, 5-methyl,5-methyl-hydrouracil,5-methyldihydropyrimidine-2,4 1h,3h-dione,2,4 1h,3h-pyrimidinedione, dihydro-5-methyl,5,6-dihydro-5-methyl-2,4-dioxypyrimidine,5,6-dihydro-2,4-dihydroxy-5-methylpyrimidine PubChem CID: 93556 ChEBI: CHEBI:27468 IUPAC Name: 5-methyl-1,3-diazinane-2,4-dione SMILES: CC1CNC(=O)NC1=O
| PubChem CID | 93556 |
|---|---|
| CAS | 696-04-8 |
| Molecular Weight (g/mol) | 128.13 |
| ChEBI | CHEBI:27468 |
| MDL Number | MFCD00023159 |
| SMILES | CC1CNC(=O)NC1=O |
| Synonym | dihydrothymine,5,6-dihydro-5-methyluracil,5,6-dihydrothymine,5-methyl-5,6-dihydrouracil,hydrouracil, 5-methyl,5-methyl-hydrouracil,5-methyldihydropyrimidine-2,4 1h,3h-dione,2,4 1h,3h-pyrimidinedione, dihydro-5-methyl,5,6-dihydro-5-methyl-2,4-dioxypyrimidine,5,6-dihydro-2,4-dihydroxy-5-methylpyrimidine |
| IUPAC Name | 5-methyl-1,3-diazinane-2,4-dione |
| InChI Key | NBAKTGXDIBVZOO-UHFFFAOYNA-N |
| Molecular Formula | C5H8N2O2 |
Thermo Scientific Chemicals 3-Methyladenine, 90+%
CAS: 5142-23-4 Molecular Formula: C6H7N5 Molecular Weight (g/mol): 149.16 MDL Number: MFCD00010531 InChI Key: FSASIHFSFGAIJM-UHFFFAOYSA-N Synonym: 3-methyladenine,3-methyl-3h-purin-6-amine,6-amino-3-methylpurine,3-ma,3h-purin-6-amine, 3-methyl,3-methyl-3h-adenine,n3-methyladenine,adenine, 3-methyl,3-methyl-3h-purin-6-ylamine,3-methyladenine 3-ma PubChem CID: 1673 ChEBI: CHEBI:38635 SMILES: CN1C=NC(N)=C2N=CN=C12
| PubChem CID | 1673 |
|---|---|
| CAS | 5142-23-4 |
| Molecular Weight (g/mol) | 149.16 |
| ChEBI | CHEBI:38635 |
| MDL Number | MFCD00010531 |
| SMILES | CN1C=NC(N)=C2N=CN=C12 |
| Synonym | 3-methyladenine,3-methyl-3h-purin-6-amine,6-amino-3-methylpurine,3-ma,3h-purin-6-amine, 3-methyl,3-methyl-3h-adenine,n3-methyladenine,adenine, 3-methyl,3-methyl-3h-purin-6-ylamine,3-methyladenine 3-ma |
| InChI Key | FSASIHFSFGAIJM-UHFFFAOYSA-N |
| Molecular Formula | C6H7N5 |
4-Nitroquinoline-N-oxide, 98%
CAS: 56-57-5 Molecular Formula: C9H6N2O3 Molecular Weight (g/mol): 190.16 MDL Number: MFCD00006738 InChI Key: YHQDZJICGQWFHK-UHFFFAOYSA-N Synonym: 4-nitroquinoline n-oxide,4-nitroquinoline 1-oxide,4-nitroquinoline-1-oxide,nitrochin,4-nitroquinoline-n-oxide,4-nqo,quinoline, 4-nitro-, 1-oxide,4-nitroquinoline oxide,4 nqo,4-nitroquinolin-1-oxide PubChem CID: 5955 ChEBI: CHEBI:16907 IUPAC Name: 4-nitro-1-oxidoquinolin-1-ium SMILES: [O-][N+](=O)C1=C2C=CC=CC2=[N+]([O-])C=C1
| PubChem CID | 5955 |
|---|---|
| CAS | 56-57-5 |
| Molecular Weight (g/mol) | 190.16 |
| ChEBI | CHEBI:16907 |
| MDL Number | MFCD00006738 |
| SMILES | [O-][N+](=O)C1=C2C=CC=CC2=[N+]([O-])C=C1 |
| Synonym | 4-nitroquinoline n-oxide,4-nitroquinoline 1-oxide,4-nitroquinoline-1-oxide,nitrochin,4-nitroquinoline-n-oxide,4-nqo,quinoline, 4-nitro-, 1-oxide,4-nitroquinoline oxide,4 nqo,4-nitroquinolin-1-oxide |
| IUPAC Name | 4-nitro-1-oxidoquinolin-1-ium |
| InChI Key | YHQDZJICGQWFHK-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O3 |
(S)-(+)-5-Hydroxymethyl-2-pyrrolidinone, 97%
CAS: 17342-08-4 Molecular Formula: C5H9NO2 Molecular Weight (g/mol): 115.13 MDL Number: MFCD00077792 InChI Key: HOBJEFOCIRXQKH-BYPYZUCNSA-N Synonym: l-pyroglutaminol,s-+-5-hydroxymethyl-2-pyrrolidinone,5s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl-2-pyrrolidinone,2-pyrrolidinone, 5-hydroxymethyl-, 5s,s-pyroglutaminol,l-pyroglutamol,pubchem13847 PubChem CID: 643511 IUPAC Name: (5S)-5-(hydroxymethyl)pyrrolidin-2-one SMILES: C1CC(=O)NC1CO
| PubChem CID | 643511 |
|---|---|
| CAS | 17342-08-4 |
| Molecular Weight (g/mol) | 115.13 |
| MDL Number | MFCD00077792 |
| SMILES | C1CC(=O)NC1CO |
| Synonym | l-pyroglutaminol,s-+-5-hydroxymethyl-2-pyrrolidinone,5s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl pyrrolidin-2-one,s-5-hydroxymethyl-2-pyrrolidinone,2-pyrrolidinone, 5-hydroxymethyl-, 5s,s-pyroglutaminol,l-pyroglutamol,pubchem13847 |
| IUPAC Name | (5S)-5-(hydroxymethyl)pyrrolidin-2-one |
| InChI Key | HOBJEFOCIRXQKH-BYPYZUCNSA-N |
| Molecular Formula | C5H9NO2 |
Guanine, 98%
CAS: 73-40-5 Molecular Formula: C5H5N5O Molecular Weight (g/mol): 151.13 MDL Number: MFCD00071533 InChI Key: UYTPUPDQBNUYGX-UHFFFAOYSA-N Synonym: guanine,2-amino-6-hydroxypurine,guanin,2-aminohypoxanthine,mearlmaid,pearl essence,guanine enol,stella polaris,dew pearl,natural pearl essence PubChem CID: 764 ChEBI: CHEBI:16235 SMILES: NC1=NC(=O)C2=C(N1)N=CN2
| PubChem CID | 764 |
|---|---|
| CAS | 73-40-5 |
| Molecular Weight (g/mol) | 151.13 |
| ChEBI | CHEBI:16235 |
| MDL Number | MFCD00071533 |
| SMILES | NC1=NC(=O)C2=C(N1)N=CN2 |
| Synonym | guanine,2-amino-6-hydroxypurine,guanin,2-aminohypoxanthine,mearlmaid,pearl essence,guanine enol,stella polaris,dew pearl,natural pearl essence |
| InChI Key | UYTPUPDQBNUYGX-UHFFFAOYSA-N |
| Molecular Formula | C5H5N5O |
Chelerythrine chloride, 99+%
CAS: 3895-92-9 Molecular Formula: C21H18ClNO4 Molecular Weight (g/mol): 383.83 MDL Number: MFCD00060717 InChI Key: WEEFNMFMNMASJY-UHFFFAOYSA-M Synonym: chelerythrine chloride,chelerythrine hydrochloride,chelerythrinechloride,unii-7ic98tz0pz,1,2-dimethoxy-12-methyl-1,3 dioxolo 4',5':4,5 benzo 1,2-c phenanthridin-12-ium chloride,chelerythrine, chloride,7ic98tz0pz,1,2-dimethoxy-n-methyl-1,3-benzodioxolo 5,6c phenanthridinium,1,2-dimethoxy-12-methyl 1,3 benzodioxolo 5,6-c phenanthridinium chloride PubChem CID: 72311 SMILES: [Cl-].COC1=CC=C2C(C=[N+](C)C3=C2C=CC2=CC4=C(OCO4)C=C32)=C1OC
| PubChem CID | 72311 |
|---|---|
| CAS | 3895-92-9 |
| Molecular Weight (g/mol) | 383.83 |
| MDL Number | MFCD00060717 |
| SMILES | [Cl-].COC1=CC=C2C(C=[N+](C)C3=C2C=CC2=CC4=C(OCO4)C=C32)=C1OC |
| Synonym | chelerythrine chloride,chelerythrine hydrochloride,chelerythrinechloride,unii-7ic98tz0pz,1,2-dimethoxy-12-methyl-1,3 dioxolo 4',5':4,5 benzo 1,2-c phenanthridin-12-ium chloride,chelerythrine, chloride,7ic98tz0pz,1,2-dimethoxy-n-methyl-1,3-benzodioxolo 5,6c phenanthridinium,1,2-dimethoxy-12-methyl 1,3 benzodioxolo 5,6-c phenanthridinium chloride |
| InChI Key | WEEFNMFMNMASJY-UHFFFAOYSA-M |
| Molecular Formula | C21H18ClNO4 |
L-Pyroglutamic Acid 97.0+%, TCI America™
CAS: 98-79-3 Molecular Formula: C5H7NO3 Molecular Weight (g/mol): 129.12 MDL Number: MFCD00005272 InChI Key: ODHCTXKNWHHXJC-UHFFFAOYNA-N Synonym: l-pyroglutamic acid,pyroglutamic acid,pidolic acid,5-oxo-l-proline,h-pyr-oh,5-oxoproline,s-5-oxopyrrolidine-2-carboxylic acid,2s-5-oxopyrrolidine-2-carboxylic acid,l-5-oxoproline,l-proline, 5-oxo PubChem CID: 7405 ChEBI: CHEBI:18183 IUPAC Name: 5-oxopyrrolidine-2-carboxylic acid SMILES: OC(=O)C1CCC(=O)N1
| PubChem CID | 7405 |
|---|---|
| CAS | 98-79-3 |
| Molecular Weight (g/mol) | 129.12 |
| ChEBI | CHEBI:18183 |
| MDL Number | MFCD00005272 |
| SMILES | OC(=O)C1CCC(=O)N1 |
| Synonym | l-pyroglutamic acid,pyroglutamic acid,pidolic acid,5-oxo-l-proline,h-pyr-oh,5-oxoproline,s-5-oxopyrrolidine-2-carboxylic acid,2s-5-oxopyrrolidine-2-carboxylic acid,l-5-oxoproline,l-proline, 5-oxo |
| IUPAC Name | 5-oxopyrrolidine-2-carboxylic acid |
| InChI Key | ODHCTXKNWHHXJC-UHFFFAOYNA-N |
| Molecular Formula | C5H7NO3 |
Sulfamethoxazole 98.0+%, TCI America™
CAS: 723-46-6 Molecular Formula: C10H11N3O3S Molecular Weight (g/mol): 253.276 MDL Number: MFCD00010546 InChI Key: JLKIGFTWXXRPMT-UHFFFAOYSA-N Synonym: sulfamethoxazole,sulphamethoxazole,sulfisomezole,gantanol,sulfamethoxazol,metoxal,sulfamethylisoxazole,simsinomin,radonil,sinomin PubChem CID: 5329 ChEBI: CHEBI:9332 IUPAC Name: 4-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide SMILES: CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N
| PubChem CID | 5329 |
|---|---|
| CAS | 723-46-6 |
| Molecular Weight (g/mol) | 253.276 |
| ChEBI | CHEBI:9332 |
| MDL Number | MFCD00010546 |
| SMILES | CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N |
| Synonym | sulfamethoxazole,sulphamethoxazole,sulfisomezole,gantanol,sulfamethoxazol,metoxal,sulfamethylisoxazole,simsinomin,radonil,sinomin |
| IUPAC Name | 4-amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide |
| InChI Key | JLKIGFTWXXRPMT-UHFFFAOYSA-N |
| Molecular Formula | C10H11N3O3S |
1-Methylindole-3-carboxaldehyde, 98+%
CAS: 19012-03-4 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00014570 InChI Key: KXYBYRKRRGSZCX-UHFFFAOYSA-N Synonym: 1-methyl-1h-indole-3-carbaldehyde,1-methylindole-3-carboxaldehyde,1-methyl-indole-3-carbaldehyde,1h-indole-3-carboxaldehyde, 1-methyl,3-formyl-1-methylindole,1-methyl-3-formylindole,n-methyl-3-formylindole,indole-3-carboxaldehyde, 1-methyl,3-formyl-1-methyl-1h-indole,n-methyl-3-indolecarboxaldehyde PubChem CID: 87894 IUPAC Name: 1-methylindole-3-carbaldehyde SMILES: CN1C=C(C=O)C2=CC=CC=C12
| PubChem CID | 87894 |
|---|---|
| CAS | 19012-03-4 |
| Molecular Weight (g/mol) | 159.19 |
| MDL Number | MFCD00014570 |
| SMILES | CN1C=C(C=O)C2=CC=CC=C12 |
| Synonym | 1-methyl-1h-indole-3-carbaldehyde,1-methylindole-3-carboxaldehyde,1-methyl-indole-3-carbaldehyde,1h-indole-3-carboxaldehyde, 1-methyl,3-formyl-1-methylindole,1-methyl-3-formylindole,n-methyl-3-formylindole,indole-3-carboxaldehyde, 1-methyl,3-formyl-1-methyl-1h-indole,n-methyl-3-indolecarboxaldehyde |
| IUPAC Name | 1-methylindole-3-carbaldehyde |
| InChI Key | KXYBYRKRRGSZCX-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
2,2'-Azobis[2-(2-imidazolin-2-yl)propane] Dihydrochloride 98.0+%, TCI America™
CAS: 27776-21-2 Molecular Formula: C12H24Cl2N6 Molecular Weight (g/mol): 323.27 MDL Number: MFCD00142723 InChI Key: ZVVWZIADMMTPBX-UHFFFAOYNA-N PubChem CID: 9949101 IUPAC Name: dihydrogen 2-(1-{2-[2-(4,5-dihydro-1H-imidazol-2-yl)propyl]diazen-1-yl}propan-2-yl)-4,5-dihydro-1H-imidazole dichloride SMILES: [H+].[H+].[Cl-].[Cl-].CC(CN=NCC(C)C1=NCCN1)C1=NCCN1
| PubChem CID | 9949101 |
|---|---|
| CAS | 27776-21-2 |
| Molecular Weight (g/mol) | 323.27 |
| MDL Number | MFCD00142723 |
| SMILES | [H+].[H+].[Cl-].[Cl-].CC(CN=NCC(C)C1=NCCN1)C1=NCCN1 |
| IUPAC Name | dihydrogen 2-(1-{2-[2-(4,5-dihydro-1H-imidazol-2-yl)propyl]diazen-1-yl}propan-2-yl)-4,5-dihydro-1H-imidazole dichloride |
| InChI Key | ZVVWZIADMMTPBX-UHFFFAOYNA-N |
| Molecular Formula | C12H24Cl2N6 |
1,1'-Oxalyldiimidazole 95.0+%, TCI America™
CAS: 18637-83-7 Molecular Formula: C8H6N4O2 Molecular Weight (g/mol): 190.16 MDL Number: MFCD00043067 InChI Key: ONRNRVLJHFFBJG-UHFFFAOYSA-N Synonym: 1,1'-oxalyldiimidazole,1,2-di 1h-imidazol-1-yl ethane-1,2-dione,1h-imidazole, 1,1'-1,2-dioxo-1,2-ethanediyl bis,oxalic acid diimidazolide,1,2-di imidazol-1-yl ethane-1,2-dione,bis imidazol-1-yl ethane-1,2-dione,1,1-oxalyldiimidazole,acmc-1cacg,1,1'-oxalyl-diimidazol,1,1'-oxalyldi 1h-imidazole PubChem CID: 100439 IUPAC Name: bis(1H-imidazol-1-yl)ethane-1,2-dione SMILES: O=C(N1C=CN=C1)C(=O)N1C=CN=C1
| PubChem CID | 100439 |
|---|---|
| CAS | 18637-83-7 |
| Molecular Weight (g/mol) | 190.16 |
| MDL Number | MFCD00043067 |
| SMILES | O=C(N1C=CN=C1)C(=O)N1C=CN=C1 |
| Synonym | 1,1'-oxalyldiimidazole,1,2-di 1h-imidazol-1-yl ethane-1,2-dione,1h-imidazole, 1,1'-1,2-dioxo-1,2-ethanediyl bis,oxalic acid diimidazolide,1,2-di imidazol-1-yl ethane-1,2-dione,bis imidazol-1-yl ethane-1,2-dione,1,1-oxalyldiimidazole,acmc-1cacg,1,1'-oxalyl-diimidazol,1,1'-oxalyldi 1h-imidazole |
| IUPAC Name | bis(1H-imidazol-1-yl)ethane-1,2-dione |
| InChI Key | ONRNRVLJHFFBJG-UHFFFAOYSA-N |
| Molecular Formula | C8H6N4O2 |
Indole-3-carboxylic acid, 98%
CAS: 771-50-6 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005624 InChI Key: KMAKOBLIOCQGJP-UHFFFAOYSA-N Synonym: indole-3-carboxylic acid,3-indoleformic acid,3-carboxyindole,indole-3-carboxylicacid,3-indolecarboxylic acid,indole-3-carboxylate,3-indolylcarboxylic acid,beta-indolylcarboxylic acid,indole-3 carboxylic acid,ico PubChem CID: 69867 ChEBI: CHEBI:24809 IUPAC Name: 1H-indole-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=CN2)C(=O)O
| PubChem CID | 69867 |
|---|---|
| CAS | 771-50-6 |
| Molecular Weight (g/mol) | 161.16 |
| ChEBI | CHEBI:24809 |
| MDL Number | MFCD00005624 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)C(=O)O |
| Synonym | indole-3-carboxylic acid,3-indoleformic acid,3-carboxyindole,indole-3-carboxylicacid,3-indolecarboxylic acid,indole-3-carboxylate,3-indolylcarboxylic acid,beta-indolylcarboxylic acid,indole-3 carboxylic acid,ico |
| IUPAC Name | 1H-indole-3-carboxylic acid |
| InChI Key | KMAKOBLIOCQGJP-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2 |
Neocuproine Hydrochloride Monohydrate, 99%
CAS: 303136-82-5 Molecular Formula: C14H12N2 Molecular Weight (g/mol): 208.26 MDL Number: MFCD00150062 InChI Key: IYRGXJIJGHOCFS-UHFFFAOYSA-N Synonym: 2,9-dimethyl-1,10-phenanthroline hydrochloride monohydrate,2,9-dimethyl-1,10-phenanthroline hydrochloride hydrate,neocuproine hydrochloride monohydrate,neocuproine hydrate hydrochloride,c14h12n2.hcl.h2o,2,9-dimethyl-1,10-phenanthroline hydrate hydrochloride,neocuproine hydrochloride hydrate,neocuproinehydrochloridemonohydrate,neocuproine hydrochloride hydrate 98,neocuproine hydrochloride trihydrate, 98 % PubChem CID: 2723838 IUPAC Name: 2,9-dimethyl-1,10-phenanthroline;hydrate;hydrochloride SMILES: CC1=CC=C2C=CC3=CC=C(C)N=C3C2=N1
| PubChem CID | 2723838 |
|---|---|
| CAS | 303136-82-5 |
| Molecular Weight (g/mol) | 208.26 |
| MDL Number | MFCD00150062 |
| SMILES | CC1=CC=C2C=CC3=CC=C(C)N=C3C2=N1 |
| Synonym | 2,9-dimethyl-1,10-phenanthroline hydrochloride monohydrate,2,9-dimethyl-1,10-phenanthroline hydrochloride hydrate,neocuproine hydrochloride monohydrate,neocuproine hydrate hydrochloride,c14h12n2.hcl.h2o,2,9-dimethyl-1,10-phenanthroline hydrate hydrochloride,neocuproine hydrochloride hydrate,neocuproinehydrochloridemonohydrate,neocuproine hydrochloride hydrate 98,neocuproine hydrochloride trihydrate, 98 % |
| IUPAC Name | 2,9-dimethyl-1,10-phenanthroline;hydrate;hydrochloride |
| InChI Key | IYRGXJIJGHOCFS-UHFFFAOYSA-N |
| Molecular Formula | C14H12N2 |