Imidazopyrimidines

Imidazopyrimidines
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Caffeine, 99%
CAS: 58-08-2 Formule moléculaire: C8H10N4O2 Poids moléculaire (g/mol): 194.19 Numéro MDL: MFCD00005758 Clé InChI: RYYVLZVUVIJVGH-UHFFFAOYSA-N Synonyme: caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep CID PubChem: 2519 ChEBI: CHEBI:27732 SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C
Poids moléculaire (g/mol) | 194.19 |
---|---|
Synonyme | caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep |
Numéro MDL | MFCD00005758 |
CAS | 58-08-2 |
CID PubChem | 2519 |
ChEBI | CHEBI:27732 |
Clé InChI | RYYVLZVUVIJVGH-UHFFFAOYSA-N |
SMILES | CN1C=NC2=C1C(=O)N(C)C(=O)N2C |
Formule moléculaire | C8H10N4O2 |
Caffeine, 99.7%
CAS: 58-08-2 Formule moléculaire: C8H10N4O2 Poids moléculaire (g/mol): 194.19 Numéro MDL: MFCD00005758 Clé InChI: RYYVLZVUVIJVGH-UHFFFAOYSA-N Synonyme: caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep CID PubChem: 2519 ChEBI: CHEBI:27732 Nom IUPAC: 1,3,7-trimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C
Poids moléculaire (g/mol) | 194.19 |
---|---|
Synonyme | caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep |
Numéro MDL | MFCD00005758 |
CAS | 58-08-2 |
CID PubChem | 2519 |
ChEBI | CHEBI:27732 |
Nom IUPAC | 1,3,7-trimethylpurine-2,6-dione |
Clé InChI | RYYVLZVUVIJVGH-UHFFFAOYSA-N |
SMILES | CN1C=NC2=C1C(=O)N(C)C(=O)N2C |
Formule moléculaire | C8H10N4O2 |
Thermo Scientific Chemicals Adenine sulfate, 98+%
CAS: 321-30-2 Formule moléculaire: C10H12N10O4S Poids moléculaire (g/mol): 368.33 Numéro MDL: MFCD00213655 Clé InChI: LQXHSCOPYJCOMD-UHFFFAOYSA-N Synonyme: adenine sulfate,adenine hemisulfate,7h-purin-6-amine sulfate 2:1,adeninsulfat,adeninium sulfate,adenine sulfate 2:1,adeninsulfat german,1h-purin-6-amine, sulfate 2:1,diadenine sulphate,unii-741gjf3k9m CID PubChem: 9449 Nom IUPAC: 7H-purin-6-amine;sulfuric acid SMILES: OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1
Poids moléculaire (g/mol) | 368.33 |
---|---|
Synonyme | adenine sulfate,adenine hemisulfate,7h-purin-6-amine sulfate 2:1,adeninsulfat,adeninium sulfate,adenine sulfate 2:1,adeninsulfat german,1h-purin-6-amine, sulfate 2:1,diadenine sulphate,unii-741gjf3k9m |
Numéro MDL | MFCD00213655 |
CAS | 321-30-2 |
CID PubChem | 9449 |
Nom IUPAC | 7H-purin-6-amine;sulfuric acid |
Clé InChI | LQXHSCOPYJCOMD-UHFFFAOYSA-N |
SMILES | OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1 |
Formule moléculaire | C10H12N10O4S |
Theophylline, 99+%, anhydrous
CAS: 58-55-9 Formule moléculaire: C7H8N4O2 Poids moléculaire (g/mol): 180.17 Numéro MDL: MFCD00079619 Clé InChI: ZFXYFBGIUFBOJW-UHFFFAOYSA-N Synonyme: theophylline,1,3-dimethylxanthine,elixophyllin,theophyllin,theolair,nuelin,theophylline anhydrous,respbid,theocin,theo-dur CID PubChem: 2153 ChEBI: CHEBI:28177 Nom IUPAC: 1,3-dimethyl-7H-purine-2,6-dione SMILES: CN1C2=C(C(=O)N(C1=O)C)NC=N2
Poids moléculaire (g/mol) | 180.17 |
---|---|
Synonyme | theophylline,1,3-dimethylxanthine,elixophyllin,theophyllin,theolair,nuelin,theophylline anhydrous,respbid,theocin,theo-dur |
Numéro MDL | MFCD00079619 |
CAS | 58-55-9 |
CID PubChem | 2153 |
ChEBI | CHEBI:28177 |
Nom IUPAC | 1,3-dimethyl-7H-purine-2,6-dione |
Clé InChI | ZFXYFBGIUFBOJW-UHFFFAOYSA-N |
SMILES | CN1C2=C(C(=O)N(C1=O)C)NC=N2 |
Formule moléculaire | C7H8N4O2 |
Theobromine, 99%
CAS: 83-67-0 Formule moléculaire: C7H8N4O2 Poids moléculaire (g/mol): 180.17 Numéro MDL: MFCD00022830 Clé InChI: YAPQBXQYLJRXSA-UHFFFAOYSA-N Synonyme: theobromine,3,7-dimethylxanthine,diurobromine,teobromin,theosalvose,theostene,santheose,thesodate,thesal,theobromin CID PubChem: 5429 ChEBI: CHEBI:28946 Nom IUPAC: 3,7-dimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)NC(=O)N2C
Poids moléculaire (g/mol) | 180.17 |
---|---|
Synonyme | theobromine,3,7-dimethylxanthine,diurobromine,teobromin,theosalvose,theostene,santheose,thesodate,thesal,theobromin |
Numéro MDL | MFCD00022830 |
CAS | 83-67-0 |
CID PubChem | 5429 |
ChEBI | CHEBI:28946 |
Nom IUPAC | 3,7-dimethylpurine-2,6-dione |
Clé InChI | YAPQBXQYLJRXSA-UHFFFAOYSA-N |
SMILES | CN1C=NC2=C1C(=O)NC(=O)N2C |
Formule moléculaire | C7H8N4O2 |
Thermo Scientific Chemicals Adenine sulfate, 98%, synthetic
CAS: 321-30-2 Formule moléculaire: C10H12N10O4S Poids moléculaire (g/mol): 368.33 Numéro MDL: MFCD00213655 Clé InChI: LQXHSCOPYJCOMD-UHFFFAOYSA-N Synonyme: adenine sulfate,adenine hemisulfate,7h-purin-6-amine sulfate 2:1,adeninsulfat,adeninium sulfate,adenine sulfate 2:1,adeninsulfat german,1h-purin-6-amine, sulfate 2:1,diadenine sulphate,unii-741gjf3k9m CID PubChem: 9449 Nom IUPAC: 7H-purin-6-amine;sulfuric acid SMILES: OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1
Poids moléculaire (g/mol) | 368.33 |
---|---|
Synonyme | adenine sulfate,adenine hemisulfate,7h-purin-6-amine sulfate 2:1,adeninsulfat,adeninium sulfate,adenine sulfate 2:1,adeninsulfat german,1h-purin-6-amine, sulfate 2:1,diadenine sulphate,unii-741gjf3k9m |
Numéro MDL | MFCD00213655 |
CAS | 321-30-2 |
CID PubChem | 9449 |
Nom IUPAC | 7H-purin-6-amine;sulfuric acid |
Clé InChI | LQXHSCOPYJCOMD-UHFFFAOYSA-N |
SMILES | OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1 |
Formule moléculaire | C10H12N10O4S |
2-Fluoroadenine, 97%
CAS: 700-49-2 Formule moléculaire: C5H4FN5 Poids moléculaire (g/mol): 153.12 Numéro MDL: MFCD01632749 Clé InChI: WKMPTBDYDNUJLF-UHFFFAOYSA-N Synonyme: 2-fluoroadenine,2-fluoro-6-aminopurine,2-fluoro-1h-purin-6-amine,2-fad,2-fluoro-9h-purin-6-amine,6-amino-2-fluoropurine,2-fluoro-7 9 h-purin-6-ylamine,purine, 6-amino-2-fluoro,fluoroadenine,1h-purin-6-amine, 2-fluoro CID PubChem: 12790 ChEBI: CHEBI:72457 Nom IUPAC: 2-fluoro-7H-purin-6-amine SMILES: NC1=C2NC=NC2=NC(F)=N1
Poids moléculaire (g/mol) | 153.12 |
---|---|
Synonyme | 2-fluoroadenine,2-fluoro-6-aminopurine,2-fluoro-1h-purin-6-amine,2-fad,2-fluoro-9h-purin-6-amine,6-amino-2-fluoropurine,2-fluoro-7 9 h-purin-6-ylamine,purine, 6-amino-2-fluoro,fluoroadenine,1h-purin-6-amine, 2-fluoro |
Numéro MDL | MFCD01632749 |
CAS | 700-49-2 |
CID PubChem | 12790 |
ChEBI | CHEBI:72457 |
Nom IUPAC | 2-fluoro-7H-purin-6-amine |
Clé InChI | WKMPTBDYDNUJLF-UHFFFAOYSA-N |
SMILES | NC1=C2NC=NC2=NC(F)=N1 |
Formule moléculaire | C5H4FN5 |
Thermo Scientific Chemicals Xanthosine dihydrate, 99%
CAS: 5968-90-1 Formule moléculaire: C10H12N4O6·2H2O Poids moléculaire (g/mol): 320.26 Clé InChI: AQQAMLPKPXTPOL-GWTDSMLYSA-N Synonyme: xanthosine dihydrate,unii-1u62i480sp,9-2r,3r,4s,5r-3,4-dihydroxy-5-hydroxymethyl tetrahydrofuran-2-yl-9h-purine-2,6-diol dihydrate,xanthosine, dihydrate,xanthosine dihydrate mi,xanthosine,dihydrate,9-beta-d-ribofuranosyl xanthine dihydrate,9-,a-d-ribofuranosylxanthine,xanthosine, dihydrate 8ci,9ci CID PubChem: 91886582 Nom IUPAC: 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione;hydrate SMILES: C1=NC2=C(N1C3C(C(C(O3)CO)O)O)NC(=O)NC2=O.O
Poids moléculaire (g/mol) | 320.26 |
---|---|
Synonyme | xanthosine dihydrate,unii-1u62i480sp,9-2r,3r,4s,5r-3,4-dihydroxy-5-hydroxymethyl tetrahydrofuran-2-yl-9h-purine-2,6-diol dihydrate,xanthosine, dihydrate,xanthosine dihydrate mi,xanthosine,dihydrate,9-beta-d-ribofuranosyl xanthine dihydrate,9-,a-d-ribofuranosylxanthine,xanthosine, dihydrate 8ci,9ci |
CAS | 5968-90-1 |
CID PubChem | 91886582 |
Nom IUPAC | 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione;hydrate |
Clé InChI | AQQAMLPKPXTPOL-GWTDSMLYSA-N |
SMILES | C1=NC2=C(N1C3C(C(C(O3)CO)O)O)NC(=O)NC2=O.O |
Formule moléculaire | C10H12N4O6·2H2O |
Thermo Scientific Chemicals 3-Methyladenine, 90+%
CAS: 5142-23-4 Formule moléculaire: C6H7N5 Poids moléculaire (g/mol): 149.16 Numéro MDL: MFCD00010531 Clé InChI: FSASIHFSFGAIJM-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 1673 ChEBI: CHEBI:38635 SMILES: CN1C=NC(N)=C2N=CN=C12
Poids moléculaire (g/mol) | 149.16 |
---|---|
Synonyme | 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 |
Numéro MDL | MFCD00010531 |
CAS | 5142-23-4 |
CID PubChem | 1673 |
ChEBI | CHEBI:38635 |
Clé InChI | FSASIHFSFGAIJM-UHFFFAOYSA-N |
SMILES | CN1C=NC(N)=C2N=CN=C12 |
Formule moléculaire | C6H7N5 |
Caffeine, 1mg/ml in methanol
CAS: 58-08-2 Formule moléculaire: C8H10N4O2 Poids moléculaire (g/mol): 194.19 Numéro MDL: MFCD00005758 Clé InChI: RYYVLZVUVIJVGH-UHFFFAOYSA-N Synonyme: caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep CID PubChem: 2519 ChEBI: CHEBI:27732 Nom IUPAC: 1,3,7-trimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C
Poids moléculaire (g/mol) | 194.19 |
---|---|
Synonyme | caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep |
Numéro MDL | MFCD00005758 |
CAS | 58-08-2 |
CID PubChem | 2519 |
ChEBI | CHEBI:27732 |
Nom IUPAC | 1,3,7-trimethylpurine-2,6-dione |
Clé InChI | RYYVLZVUVIJVGH-UHFFFAOYSA-N |
SMILES | CN1C=NC2=C1C(=O)N(C)C(=O)N2C |
Formule moléculaire | C8H10N4O2 |
Thermo Scientific Chemicals Adenine hydrochloride, 98+%, cont. up to ca 5% water
CAS: 2922-28-3 Formule moléculaire: C5H6ClN5 Poids moléculaire (g/mol): 171.59 Numéro MDL: MFCD00038990 Clé InChI: UQVDQSWZQXDUJB-UHFFFAOYSA-N Synonyme: adenine hydrochloride,7h-purin-6-amine hydrochloride,6-aminopurine hydrochloride,1h-purin-6-amine, monohydrochloride,adenine monohydrochloride,unii-364h11m7od,adenine hcl,1h-purin-6-amine, hydrochloride,9h-purin-6-amine, hydrochloride 1:?,9h-purin-6-amine, hydrochloride 1:1 CID PubChem: 76219 Nom IUPAC: 7H-purin-6-amine;hydrochloride SMILES: Cl.NC1=C2NC=NC2=NC=N1
Poids moléculaire (g/mol) | 171.59 |
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Synonyme | adenine hydrochloride,7h-purin-6-amine hydrochloride,6-aminopurine hydrochloride,1h-purin-6-amine, monohydrochloride,adenine monohydrochloride,unii-364h11m7od,adenine hcl,1h-purin-6-amine, hydrochloride,9h-purin-6-amine, hydrochloride 1:?,9h-purin-6-amine, hydrochloride 1:1 |
Numéro MDL | MFCD00038990 |
CAS | 2922-28-3 |
CID PubChem | 76219 |
Nom IUPAC | 7H-purin-6-amine;hydrochloride |
Clé InChI | UQVDQSWZQXDUJB-UHFFFAOYSA-N |
SMILES | Cl.NC1=C2NC=NC2=NC=N1 |
Formule moléculaire | C5H6ClN5 |
4,6-Dihydroxy-1H-pyrazolo[3,4-d]pyrimidine, 98+%
CAS: 2465-59-0 Formule moléculaire: C5H4N4O2 Poids moléculaire (g/mol): 152.113 Numéro MDL: MFCD00056934 Clé InChI: HXNFUBHNUDHIGC-UHFFFAOYSA-N Synonyme: oxypurinol,oxipurinol,alloxanthine,1h-pyrazolo 3,4-d pyrimidine-4,6-diol,oxoallopurinol,4,6-dihydroxypyrazolo 3,4-d pyrimidine,1h-pyrazolo 3,4-d pyrimidine-4,6 5h,7h-dione,oxipurinolum,1h-pyrazolo 3,4-d pyrimidine-4,6 2h,5h-dione,alloxanthin van CID PubChem: 4644 ChEBI: CHEBI:28315 Nom IUPAC: 1,2-dihydropyrazolo[3,4-d]pyrimidine-4,6-dione SMILES: C1=C2C(=NC(=O)NC2=O)NN1
Poids moléculaire (g/mol) | 152.113 |
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Synonyme | oxypurinol,oxipurinol,alloxanthine,1h-pyrazolo 3,4-d pyrimidine-4,6-diol,oxoallopurinol,4,6-dihydroxypyrazolo 3,4-d pyrimidine,1h-pyrazolo 3,4-d pyrimidine-4,6 5h,7h-dione,oxipurinolum,1h-pyrazolo 3,4-d pyrimidine-4,6 2h,5h-dione,alloxanthin van |
Numéro MDL | MFCD00056934 |
CAS | 2465-59-0 |
CID PubChem | 4644 |
ChEBI | CHEBI:28315 |
Nom IUPAC | 1,2-dihydropyrazolo[3,4-d]pyrimidine-4,6-dione |
Clé InChI | HXNFUBHNUDHIGC-UHFFFAOYSA-N |
SMILES | C1=C2C(=NC(=O)NC2=O)NN1 |
Formule moléculaire | C5H4N4O2 |
3-Methylxanthine, 98+%
CAS: 1076-22-8 Formule moléculaire: C6H6N4O2 Poids moléculaire (g/mol): 166.14 Numéro MDL: MFCD00005580 Clé InChI: GMSNIKWWOQHZGF-UHFFFAOYSA-N Synonyme: 3-methylxanthine,3-methyl-1h-purine-2,6 3h,7h-dione,2,6-dihydroxy-3-methylpurine,xanthine, 3-methyl,3 mx,3-methyl xanthine,1h-purine-2,6-dione, 3,7-dihydro-3-methyl,unii-ws6x982oec,3-methyl-2,3,6,7-tetrahydro-1h-purine-2,6-dione,ccris 5817 CID PubChem: 70639 ChEBI: CHEBI:62207 Nom IUPAC: 3-methyl-7H-purine-2,6-dione SMILES: CN1C2=C(C(=O)NC1=O)NC=N2
Poids moléculaire (g/mol) | 166.14 |
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Synonyme | 3-methylxanthine,3-methyl-1h-purine-2,6 3h,7h-dione,2,6-dihydroxy-3-methylpurine,xanthine, 3-methyl,3 mx,3-methyl xanthine,1h-purine-2,6-dione, 3,7-dihydro-3-methyl,unii-ws6x982oec,3-methyl-2,3,6,7-tetrahydro-1h-purine-2,6-dione,ccris 5817 |
Numéro MDL | MFCD00005580 |
CAS | 1076-22-8 |
CID PubChem | 70639 |
ChEBI | CHEBI:62207 |
Nom IUPAC | 3-methyl-7H-purine-2,6-dione |
Clé InChI | GMSNIKWWOQHZGF-UHFFFAOYSA-N |
SMILES | CN1C2=C(C(=O)NC1=O)NC=N2 |
Formule moléculaire | C6H6N4O2 |
MilliporeSigma™ Adenine, ≥98%, Calbiochem™,
CAS: 73-24-5 Formule moléculaire: C5H5N5 Poids moléculaire (g/mol): 135.13 Numéro MDL: MFCD00041790 Clé InChI: GFFGJBXGBJISGV-UHFFFAOYSA-N Synonyme: adenine,1h-purin-6-amine,6-aminopurine,9h-purin-6-amine,vitamin b4,adenin,adeninimine,leuco-4,6-amino-1h-purine,6-amino-3h-purine CID PubChem: 190 ChEBI: CHEBI:16708 Nom IUPAC: 7H-purin-6-amine SMILES: NC1=C2NC=NC2=NC=N1
Poids moléculaire (g/mol) | 135.13 |
---|---|
Synonyme | adenine,1h-purin-6-amine,6-aminopurine,9h-purin-6-amine,vitamin b4,adenin,adeninimine,leuco-4,6-amino-1h-purine,6-amino-3h-purine |
Numéro MDL | MFCD00041790 |
CAS | 73-24-5 |
CID PubChem | 190 |
ChEBI | CHEBI:16708 |
Nom IUPAC | 7H-purin-6-amine |
Clé InChI | GFFGJBXGBJISGV-UHFFFAOYSA-N |
SMILES | NC1=C2NC=NC2=NC=N1 |
Formule moléculaire | C5H5N5 |