Imidazopyrimidines
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Uric acid, 99%, Thermo Scientific Chemicals
CAS: 69-93-2 Molecular Formula: C5H4N4O3 Molecular Weight (g/mol): 168.112 MDL Number: MFCD00005712 InChI Key: LEHOTFFKMJEONL-UHFFFAOYSA-N Synonym: uric acid,urate,2,6,8-trioxypurine,lithic acid,2,6,8-trihydroxypurine,2,6,8-trioxopurine,1h-purine-2,6,8-triol,8-hydroxyxanthine,7,9-dihydro-1h-purine-2,6,8 3h-trione,1h-purine-2,6,8 3h-trione, 7,9-dihydro PubChem CID: 1175 ChEBI: CHEBI:17775 IUPAC Name: 7,9-dihydro-3H-purine-2,6,8-trione SMILES: C12=C(NC(=O)N1)NC(=O)NC2=O
| PubChem CID | 1175 |
|---|---|
| CAS | 69-93-2 |
| Molecular Weight (g/mol) | 168.112 |
| ChEBI | CHEBI:17775 |
| MDL Number | MFCD00005712 |
| SMILES | C12=C(NC(=O)N1)NC(=O)NC2=O |
| Synonym | uric acid,urate,2,6,8-trioxypurine,lithic acid,2,6,8-trihydroxypurine,2,6,8-trioxopurine,1h-purine-2,6,8-triol,8-hydroxyxanthine,7,9-dihydro-1h-purine-2,6,8 3h-trione,1h-purine-2,6,8 3h-trione, 7,9-dihydro |
| IUPAC Name | 7,9-dihydro-3H-purine-2,6,8-trione |
| InChI Key | LEHOTFFKMJEONL-UHFFFAOYSA-N |
| Molecular Formula | C5H4N4O3 |
Theophylline-7-acetic acid, 98%
CAS: 652-37-9 Molecular Formula: C9H9N4NaO4 Molecular Weight (g/mol): 260.19 MDL Number: MFCD00022832 InChI Key: MSFVZSOKOXZSME-UHFFFAOYSA-M Synonym: acefylline,theophylline-7-acetic acid,acephylline,theophyllineacetic acid,carboxymethyltheophylline,7-carboxymethyl theophylline,7-theophyllinylacetic acid,theophyllin-7-ylacetic acid,7-theophyllinessigsaeure,7-theophyllineacetic acid PubChem CID: 69550 IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid SMILES: [Na+].CN1C2=C(N(CC([O-])=O)C=N2)C(=O)N(C)C1=O
| PubChem CID | 69550 |
|---|---|
| CAS | 652-37-9 |
| Molecular Weight (g/mol) | 260.19 |
| MDL Number | MFCD00022832 |
| SMILES | [Na+].CN1C2=C(N(CC([O-])=O)C=N2)C(=O)N(C)C1=O |
| Synonym | acefylline,theophylline-7-acetic acid,acephylline,theophyllineacetic acid,carboxymethyltheophylline,7-carboxymethyl theophylline,7-theophyllinylacetic acid,theophyllin-7-ylacetic acid,7-theophyllinessigsaeure,7-theophyllineacetic acid |
| IUPAC Name | 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid |
| InChI Key | MSFVZSOKOXZSME-UHFFFAOYSA-M |
| Molecular Formula | C9H9N4NaO4 |
Uric acid, 99% max., MP Biomedicals™
CAS: 69-93-2 Molecular Formula: C5H4N4O3 Molecular Weight (g/mol): 168.112 InChI Key: LEHOTFFKMJEONL-UHFFFAOYSA-N Synonym: uric acid,urate,2,6,8-trioxypurine,lithic acid,2,6,8-trihydroxypurine,2,6,8-trioxopurine,1h-purine-2,6,8-triol,8-hydroxyxanthine,7,9-dihydro-1h-purine-2,6,8 3h-trione,1h-purine-2,6,8 3h-trione, 7,9-dihydro PubChem CID: 1175 ChEBI: CHEBI:17775 IUPAC Name: 7,9-dihydro-3H-purine-2,6,8-trione SMILES: C12=C(NC(=O)N1)NC(=O)NC2=O
| PubChem CID | 1175 |
|---|---|
| CAS | 69-93-2 |
| Molecular Weight (g/mol) | 168.112 |
| ChEBI | CHEBI:17775 |
| SMILES | C12=C(NC(=O)N1)NC(=O)NC2=O |
| Synonym | uric acid,urate,2,6,8-trioxypurine,lithic acid,2,6,8-trihydroxypurine,2,6,8-trioxopurine,1h-purine-2,6,8-triol,8-hydroxyxanthine,7,9-dihydro-1h-purine-2,6,8 3h-trione,1h-purine-2,6,8 3h-trione, 7,9-dihydro |
| IUPAC Name | 7,9-dihydro-3H-purine-2,6,8-trione |
| InChI Key | LEHOTFFKMJEONL-UHFFFAOYSA-N |
| Molecular Formula | C5H4N4O3 |
Uric Acid, TRC
CAS: 69-93-2 Molecular Formula: C5 H4 N4 O3 Molecular Weight (g/mol): 168.11 Synonym: 7,9-Dihydro-1H-purine-2,6,8(3H)-trione (ACI),Uric acid (8CI),1H-Purine-2,6,8-triol,2,3,6,7,8,9-Hexahydro-1H-purine-2,6,8-trione,2,6,8-Trihydroxypurine,2,6,8-Trioxopurine,2,6,8-Trioxypurine,Lithic acid,NSC 3975,Purine-2,6,8(1H,3H,9H)-trione,1H-Purine-2,6,8(3H)-trione, 7,9-dihydro- (9CI, ACI) IUPAC Name: 7,9-dihydro-3H-purine-2,6,8-trione SMILES: O=C1NC(=O)C2=C(NC(=O)N2)N1
| CAS | 69-93-2 |
|---|---|
| Molecular Weight (g/mol) | 168.11 |
| SMILES | O=C1NC(=O)C2=C(NC(=O)N2)N1 |
| Synonym | 7,9-Dihydro-1H-purine-2,6,8(3H)-trione (ACI),Uric acid (8CI),1H-Purine-2,6,8-triol,2,3,6,7,8,9-Hexahydro-1H-purine-2,6,8-trione,2,6,8-Trihydroxypurine,2,6,8-Trioxopurine,2,6,8-Trioxypurine,Lithic acid,NSC 3975,Purine-2,6,8(1H,3H,9H)-trione,1H-Purine-2,6,8(3H)-trione, 7,9-dihydro- (9CI, ACI) |
| IUPAC Name | 7,9-dihydro-3H-purine-2,6,8-trione |
| Molecular Formula | C5 H4 N4 O3 |
1-Methyluric Acid, TRC
CAS: 708-79-2 Molecular Formula: C6 H6 N4 O3 Molecular Weight (g/mol): 182.14 Synonym: 7,9-Dihydro-1-methyl-1H-purine-2,6,8(3H)-trione,1-Methyl-uric Acid; IUPAC Name: 1-methyl-7,9-dihydro-3H-purine-2,6,8-trione SMILES: CN1C(=O)NC2=C(NC(=O)N2)C1=O
| CAS | 708-79-2 |
|---|---|
| Molecular Weight (g/mol) | 182.14 |
| SMILES | CN1C(=O)NC2=C(NC(=O)N2)C1=O |
| Synonym | 7,9-Dihydro-1-methyl-1H-purine-2,6,8(3H)-trione,1-Methyl-uric Acid; |
| IUPAC Name | 1-methyl-7,9-dihydro-3H-purine-2,6,8-trione |
| Molecular Formula | C6 H6 N4 O3 |
1,3-Dimethyluric Acid, TRC
CAS: 944-73-0 Molecular Formula: C7H8N4O3 Molecular Weight (g/mol): 196.16 Synonym: 7,9-Dihydro-1,3-dimethyl-1H-purine-2,6,8(3H)-trione,1,3-Dimethyl Uric Acid; IUPAC Name: 1,3-dimethyl-7,9-dihydropurine-2,6,8-trione SMILES: CN1C(=O)N(C)C2=C(NC(=O)N2)C1=O
| CAS | 944-73-0 |
|---|---|
| Molecular Weight (g/mol) | 196.16 |
| SMILES | CN1C(=O)N(C)C2=C(NC(=O)N2)C1=O |
| Synonym | 7,9-Dihydro-1,3-dimethyl-1H-purine-2,6,8(3H)-trione,1,3-Dimethyl Uric Acid; |
| IUPAC Name | 1,3-dimethyl-7,9-dihydropurine-2,6,8-trione |
| Molecular Formula | C7H8N4O3 |
Uric Acid-1,3-15N2, TRC
CAS: 62948-75-8 Molecular Formula: C5 H4 15N2 N2 O3 Molecular Weight (g/mol): 170.1 Synonym: 7,9-dihydro-1H-Purine-2,6,8(3H)-trione-1,3-15N2 IUPAC Name: 7,9-dihydro-3H-purine-2,6,8-trione SMILES: O=C1[15NH]C(=O)C2=C([15NH]1)NC(=O)N2
| CAS | 62948-75-8 |
|---|---|
| Molecular Weight (g/mol) | 170.1 |
| SMILES | O=C1[15NH]C(=O)C2=C([15NH]1)NC(=O)N2 |
| Synonym | 7,9-dihydro-1H-Purine-2,6,8(3H)-trione-1,3-15N2 |
| IUPAC Name | 7,9-dihydro-3H-purine-2,6,8-trione |
| Molecular Formula | C5 H4 15N2 N2 O3 |
Phytic acid dodecasodium hydrate, MedChemExpress
MedChemExpress Phytic acid (Inositol hexaphosphate) dodecasodium hydrate is a phosphorus storage compound of seeds and cereal grains.
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Xanthine, 98%
CAS: 69-89-6 Molecular Formula: C5H4N4O2 Molecular Weight (g/mol): 152.11 MDL Number: MFCD00078453 InChI Key: LRFVTYWOQMYALW-UHFFFAOYSA-N Synonym: xanthine,2,6-dihydroxypurine,xanthin,2,6-dioxopurine,pseudoxanthine,1h-purine-2,6 3h,7h-dione,isoxanthine,xanthic oxide,1h-purine-2,6-diol,9h-purine-2,6-diol PubChem CID: 1188 ChEBI: CHEBI:17712 IUPAC Name: 3,7-dihydropurine-2,6-dione SMILES: C1=NC2=C(N1)C(=O)NC(=O)N2
| PubChem CID | 1188 |
|---|---|
| CAS | 69-89-6 |
| Molecular Weight (g/mol) | 152.11 |
| ChEBI | CHEBI:17712 |
| MDL Number | MFCD00078453 |
| SMILES | C1=NC2=C(N1)C(=O)NC(=O)N2 |
| Synonym | xanthine,2,6-dihydroxypurine,xanthin,2,6-dioxopurine,pseudoxanthine,1h-purine-2,6 3h,7h-dione,isoxanthine,xanthic oxide,1h-purine-2,6-diol,9h-purine-2,6-diol |
| IUPAC Name | 3,7-dihydropurine-2,6-dione |
| InChI Key | LRFVTYWOQMYALW-UHFFFAOYSA-N |
| Molecular Formula | C5H4N4O2 |
Adenine Hemisulfate Dihydrate, ≥99%, MP Biomedicals™
CAS: 6509-19-9 Molecular Formula: C10H16N10O6S Molecular Weight (g/mol): 404.36 MDL Number: MFCD00150149 InChI Key: MKPCNMXYTMQZBE-UHFFFAOYSA-N Synonym: 9h-purin-6-amine hemisulfate dihydrate,adenine hemisulfate dihydrate,6-aminopurine sulfate dihydrate,bis ade sulfuric acid dihydrate,sulfuric acid bis vitamin b4 dihydrate,bis adenine sulfuric acid dihydrate,sulfuric acid-7h-purin-6-amine-water 1/2/2 PubChem CID: 44134512 IUPAC Name: bis(7H-purin-6-amine) sulfuric acid dihydrate SMILES: O.O.OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1
| PubChem CID | 44134512 |
|---|---|
| CAS | 6509-19-9 |
| Molecular Weight (g/mol) | 404.36 |
| MDL Number | MFCD00150149 |
| SMILES | O.O.OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1 |
| Synonym | 9h-purin-6-amine hemisulfate dihydrate,adenine hemisulfate dihydrate,6-aminopurine sulfate dihydrate,bis ade sulfuric acid dihydrate,sulfuric acid bis vitamin b4 dihydrate,bis adenine sulfuric acid dihydrate,sulfuric acid-7h-purin-6-amine-water 1/2/2 |
| IUPAC Name | bis(7H-purin-6-amine) sulfuric acid dihydrate |
| InChI Key | MKPCNMXYTMQZBE-UHFFFAOYSA-N |
| Molecular Formula | C10H16N10O6S |
Caffeine, citrated
CAS: 69-22-7 Molecular Formula: C14H18N4O9 Molecular Weight (g/mol): 386.32 MDL Number: MFCD00044986 InChI Key: RCQXSQPPHJPGOF-UHFFFAOYSA-N Synonym: caffeine citrate,caffeine, citrated,caffeina citrate,citrated caffein,caffeine citrate 1:1,caffeine citrated,unii-u26eo4675q,citric acid, compd. with caffeine 1:1,1,2,3-propanetricarboxylic acid, 2-hydroxy-, mixt. with 3,7-dihydro-1,3,7-trimethyl-1h-purine-2,6-dione,dsstox_cid_26938 PubChem CID: 6241 IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid;1,3,7-trimethylpurine-2,6-dione SMILES: OC(=O)CC(O)(CC(O)=O)C(O)=O.CN1C=NC2=C1C(=O)N(C)C(=O)N2C
| PubChem CID | 6241 |
|---|---|
| CAS | 69-22-7 |
| Molecular Weight (g/mol) | 386.32 |
| MDL Number | MFCD00044986 |
| SMILES | OC(=O)CC(O)(CC(O)=O)C(O)=O.CN1C=NC2=C1C(=O)N(C)C(=O)N2C |
| Synonym | caffeine citrate,caffeine, citrated,caffeina citrate,citrated caffein,caffeine citrate 1:1,caffeine citrated,unii-u26eo4675q,citric acid, compd. with caffeine 1:1,1,2,3-propanetricarboxylic acid, 2-hydroxy-, mixt. with 3,7-dihydro-1,3,7-trimethyl-1h-purine-2,6-dione,dsstox_cid_26938 |
| IUPAC Name | 2-hydroxypropane-1,2,3-tricarboxylic acid;1,3,7-trimethylpurine-2,6-dione |
| InChI Key | RCQXSQPPHJPGOF-UHFFFAOYSA-N |
| Molecular Formula | C14H18N4O9 |
Tenofovir disoproxil fumarate, 98%, Thermo Scientific Chemicals
CAS: 202138-50-9 Molecular Formula: C19H30N5O10P·C4H4O4 Molecular Weight (g/mol): 635.51 InChI Key: VCMJCVGFSROFHV-WZGZYPNHSA-N Synonym: tenofovir disoproxil fumarate,viread,tenofovir df,unii-ott9j7900i,tenofovir disoproxil fumarate usan,9-r-2-bis isopropoxycarbonyl oxy methoxy phosphinyl methoxy propyl adenine fumarate,9-r-2-bis isopropoxycarbonyl oxy methoxy phosphinyl methoxy propyl adenine, fumarate,r-5-2-6-amino-9h-purin-9-yl-1-methylethoxy methyl-2,4,6,8-tetraoxa-5-phosphanonanedioic acid, bis 1-methylethyl ester, 5-oxide, e-2-butenedioate 1:1,9-r-2-bis isopropoxycarbonyl oxy methoxy phosphinyl methoxy propyl adenine fumarate 1:1 PubChem CID: 6398764 ChEBI: CHEBI:63718 IUPAC Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;(E)-but-2-enedioic acid SMILES: CC(C)OC(=O)OCOP(=O)(COC(C)CN1C=NC2=C1N=CN=C2N)OCOC(=O)OC(C)C.C(=CC(=O)O)C(=O)O
| PubChem CID | 6398764 |
|---|---|
| CAS | 202138-50-9 |
| Molecular Weight (g/mol) | 635.51 |
| ChEBI | CHEBI:63718 |
| SMILES | CC(C)OC(=O)OCOP(=O)(COC(C)CN1C=NC2=C1N=CN=C2N)OCOC(=O)OC(C)C.C(=CC(=O)O)C(=O)O |
| Synonym | tenofovir disoproxil fumarate,viread,tenofovir df,unii-ott9j7900i,tenofovir disoproxil fumarate usan,9-r-2-bis isopropoxycarbonyl oxy methoxy phosphinyl methoxy propyl adenine fumarate,9-r-2-bis isopropoxycarbonyl oxy methoxy phosphinyl methoxy propyl adenine, fumarate,r-5-2-6-amino-9h-purin-9-yl-1-methylethoxy methyl-2,4,6,8-tetraoxa-5-phosphanonanedioic acid, bis 1-methylethyl ester, 5-oxide, e-2-butenedioate 1:1,9-r-2-bis isopropoxycarbonyl oxy methoxy phosphinyl methoxy propyl adenine fumarate 1:1 |
| IUPAC Name | [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(propan-2-yloxycarbonyloxymethoxy)phosphoryl]oxymethyl propan-2-yl carbonate;(E)-but-2-enedioic acid |
| InChI Key | VCMJCVGFSROFHV-WZGZYPNHSA-N |
| Molecular Formula | C19H30N5O10P·C4H4O4 |