Imidazopyrimidines
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Résultats de la recherche filtrée
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 |
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 |
2-Amino-6-hydroxy-8-mercaptopurine, 97%
CAS: 28128-40-7 Formule moléculaire: C5H5N5OS Poids moléculaire (g/mol): 183.19 Numéro MDL: MFCD00075623 Clé InChI: JHEKNTQSGTVPAO-UHFFFAOYSA-N Synonyme: 2-amino-6-hydroxy-8-mercaptopurine,8-mercaptoguanine,2-amino-8-mercapto-7h-purin-6-ol,2-amino-8-sulfanyl-1,9-dihydro-6h-purin-6-one,2-amino-1,7,8,9-tetrahydro-2-thioxo-6h-purin-6-one,2-amino-8-mercapto-1,9-dihydro-purin-6-one,2-amino-8-thioxo-3,7-dihydropurin-6-one,2-amino-8-sulfanyl-7h-purin-6-ol,2-amino-8-sulfanyl-9h-purin-6-ol,2-amino-8-thioxo-1,7,8,9-tetrahydro-purin-6-one CID PubChem: 2725005 Nom IUPAC: 2-amino-8-sulfanylidene-7,9-dihydro-3H-purin-6-one SMILES: C12=C(NC(=NC1=O)N)NC(=S)N2
| Poids moléculaire (g/mol) | 183.19 |
|---|---|
| Synonyme | 2-amino-6-hydroxy-8-mercaptopurine,8-mercaptoguanine,2-amino-8-mercapto-7h-purin-6-ol,2-amino-8-sulfanyl-1,9-dihydro-6h-purin-6-one,2-amino-1,7,8,9-tetrahydro-2-thioxo-6h-purin-6-one,2-amino-8-mercapto-1,9-dihydro-purin-6-one,2-amino-8-thioxo-3,7-dihydropurin-6-one,2-amino-8-sulfanyl-7h-purin-6-ol,2-amino-8-sulfanyl-9h-purin-6-ol,2-amino-8-thioxo-1,7,8,9-tetrahydro-purin-6-one |
| Numéro MDL | MFCD00075623 |
| CAS | 28128-40-7 |
| CID PubChem | 2725005 |
| Nom IUPAC | 2-amino-8-sulfanylidene-7,9-dihydro-3H-purin-6-one |
| Clé InChI | JHEKNTQSGTVPAO-UHFFFAOYSA-N |
| SMILES | C12=C(NC(=NC1=O)N)NC(=S)N2 |
| Formule moléculaire | C5H5N5OS |
2-Hydroxy-6-aminopurine, 98%
CAS: 3373-53-3 Formule moléculaire: C5H5N5O Poids moléculaire (g/mol): 151.13 Numéro MDL: MFCD00142931 Clé InChI: DRAVOWXCEBXPTN-UHFFFAOYSA-N Synonyme: isoguanine,2-hydroxyadenine,2-hydroxy-6-aminopurine,6-amino-3,7-dihydro-2h-purin-2-one,6-amino-2-hydroxypurine,6-amino-7h-purin-2-ol,2-oxoadenine,6-amino-1,3-dihydro-2h-purin-2-one,2-oxyadenine,6-amino-9h-purin-2-ol CID PubChem: 76900 ChEBI: CHEBI:62462 Nom IUPAC: 6-amino-1,7-dihydropurin-2-one SMILES: NC1=C2NC=NC2=NC(=O)N1
| Poids moléculaire (g/mol) | 151.13 |
|---|---|
| Synonyme | isoguanine,2-hydroxyadenine,2-hydroxy-6-aminopurine,6-amino-3,7-dihydro-2h-purin-2-one,6-amino-2-hydroxypurine,6-amino-7h-purin-2-ol,2-oxoadenine,6-amino-1,3-dihydro-2h-purin-2-one,2-oxyadenine,6-amino-9h-purin-2-ol |
| Numéro MDL | MFCD00142931 |
| CAS | 3373-53-3 |
| CID PubChem | 76900 |
| ChEBI | CHEBI:62462 |
| Nom IUPAC | 6-amino-1,7-dihydropurin-2-one |
| Clé InChI | DRAVOWXCEBXPTN-UHFFFAOYSA-N |
| SMILES | NC1=C2NC=NC2=NC(=O)N1 |
| Formule moléculaire | C5H5N5O |
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 |
4,6-Dihydroxypyrazolo[3,4-d]pyrimidine, 99%
CAS: 2465-59-0 Formule moléculaire: C5H4N4O2 Poids moléculaire (g/mol): 152.11 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) | 152.11 |
|---|---|
| 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 |
2',3'-O-Isopropylideneadenosine, 98%
CAS: 362-75-4 Formule moléculaire: C13H17N5O4 Poids moléculaire (g/mol): 307.31 Numéro MDL: MFCD00005756 Clé InChI: LCCLUOXEZAHUNS-AUWRGFAENA-N Synonyme: 2',3'-o-isopropylideneadenosine,3ar,4r,6r,6ar-6-6-amino-9h-purin-9-yl-2,2-dimethyltetrahydrofuro 3,4-d 1,3 dioxol-4-yl methanol,2',3'-isopropylideneadenosine,3ar,4r,6r,6ar-6-6-amino-9h-purin-9-yl-2,2-dimethyl-tetrahydro-2h-furo 3,4-d 1,3 dioxol-4-yl methanol,2 ,3-o-isopropylideneadenosine,1r,2r,4r,5r-4-6-aminopurin-9-yl-7,7-dimethyl-3,6,8-trioxabicyclo 3.3.0 oc t-2-yl methan-1-ol,3ar,4r,6r,6ar-4-6-aminopurin-9-yl-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro 3,4-d 1,3 dioxol-6-yl methanol,3ar,4r,6r,6ar-6-6-aminopurin-9-yl-2,2-dimethyl-tetrahydrofuro 3,4-d 1,3 dioxol-4-yl methanol,pubchem14185 CID PubChem: 2723654 SMILES: CC1(C)O[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O1)N1C=NC2=C(N)N=CN=C12
| Poids moléculaire (g/mol) | 307.31 |
|---|---|
| Synonyme | 2',3'-o-isopropylideneadenosine,3ar,4r,6r,6ar-6-6-amino-9h-purin-9-yl-2,2-dimethyltetrahydrofuro 3,4-d 1,3 dioxol-4-yl methanol,2',3'-isopropylideneadenosine,3ar,4r,6r,6ar-6-6-amino-9h-purin-9-yl-2,2-dimethyl-tetrahydro-2h-furo 3,4-d 1,3 dioxol-4-yl methanol,2 ,3-o-isopropylideneadenosine,1r,2r,4r,5r-4-6-aminopurin-9-yl-7,7-dimethyl-3,6,8-trioxabicyclo 3.3.0 oc t-2-yl methan-1-ol,3ar,4r,6r,6ar-4-6-aminopurin-9-yl-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro 3,4-d 1,3 dioxol-6-yl methanol,3ar,4r,6r,6ar-6-6-aminopurin-9-yl-2,2-dimethyl-tetrahydrofuro 3,4-d 1,3 dioxol-4-yl methanol,pubchem14185 |
| Numéro MDL | MFCD00005756 |
| CAS | 362-75-4 |
| CID PubChem | 2723654 |
| Clé InChI | LCCLUOXEZAHUNS-AUWRGFAENA-N |
| SMILES | CC1(C)O[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O1)N1C=NC2=C(N)N=CN=C12 |
| Formule moléculaire | C13H17N5O4 |
6-Thioguanine, 98%
CAS: 154-42-7 Formule moléculaire: C5H5N5S Poids moléculaire (g/mol): 167.19 Numéro MDL: MFCD00233553 Clé InChI: WYWHKKSPHMUBEB-UHFFFAOYSA-N Synonyme: 6-thioguanine,thioguanine,tioguanine,2-amino-6-mercaptopurine,6-mercaptoguanine,tioguanin,tabloid,lanvis,2-amino-6-purinethiol,2-aminopurine-6-thiol CID PubChem: 2723601 ChEBI: CHEBI:9555 SMILES: NC1=NC(=S)C2=C(N1)N=CN2
| Poids moléculaire (g/mol) | 167.19 |
|---|---|
| Synonyme | 6-thioguanine,thioguanine,tioguanine,2-amino-6-mercaptopurine,6-mercaptoguanine,tioguanin,tabloid,lanvis,2-amino-6-purinethiol,2-aminopurine-6-thiol |
| Numéro MDL | MFCD00233553 |
| CAS | 154-42-7 |
| CID PubChem | 2723601 |
| ChEBI | CHEBI:9555 |
| Clé InChI | WYWHKKSPHMUBEB-UHFFFAOYSA-N |
| SMILES | NC1=NC(=S)C2=C(N1)N=CN2 |
| Formule moléculaire | C5H5N5S |
Thermo Scientific Chemicals 3-Isobutyl-1-methylxanthine, 99+%
CAS: 28822-58-4 Formule moléculaire: C10H14N4O2 Poids moléculaire (g/mol): 222.25 Numéro MDL: MFCD00005584 Clé InChI: APIXJSLKIYYUKG-UHFFFAOYSA-N Synonyme: 3-isobutyl-1-methylxanthine,ibmx,isobutylmethylxanthine,1-methyl-3-isobutylxanthine,methylisobutylxanthine,3-isobutyl-1-methyl-1h-purine-2,6 3h,7h-dione,xanthine, 3-isobutyl-1-methyl,3-isobutyl-1-methyxanthine,1h-purine-2,6-dione, 3,7-dihydro-1-methyl-3-2-methylpropyl,methyl-isobutylxanthine CID PubChem: 3758 ChEBI: CHEBI:43253 SMILES: CC(C)CN1C2=C(NC=N2)C(=O)N(C)C1=O
| Poids moléculaire (g/mol) | 222.25 |
|---|---|
| Synonyme | 3-isobutyl-1-methylxanthine,ibmx,isobutylmethylxanthine,1-methyl-3-isobutylxanthine,methylisobutylxanthine,3-isobutyl-1-methyl-1h-purine-2,6 3h,7h-dione,xanthine, 3-isobutyl-1-methyl,3-isobutyl-1-methyxanthine,1h-purine-2,6-dione, 3,7-dihydro-1-methyl-3-2-methylpropyl,methyl-isobutylxanthine |
| Numéro MDL | MFCD00005584 |
| CAS | 28822-58-4 |
| CID PubChem | 3758 |
| ChEBI | CHEBI:43253 |
| Clé InChI | APIXJSLKIYYUKG-UHFFFAOYSA-N |
| SMILES | CC(C)CN1C2=C(NC=N2)C(=O)N(C)C1=O |
| Formule moléculaire | C10H14N4O2 |
9-Methyladenine, 98%, Thermo Scientific Chemicals
CAS: 700-00-5 Formule moléculaire: C6H7N5 Poids moléculaire (g/mol): 149.16 Numéro MDL: MFCD00047232 Clé InChI: WRXCXOUDSPTXNX-UHFFFAOYSA-N Synonyme: 9-methyladenine,9-methyl-9h-purin-6-amine,n9-methyladenine,9-methyl-9h-adenine,6-amino-9-methylpurine,9h-purin-6-amine, 9-methyl,adenine, 9-methyl,9-methyl-9h-purin-6-ylamine,ccris 6905,chembl65976 CID PubChem: 69689 ChEBI: CHEBI:40526 Nom IUPAC: 9-methylpurin-6-amine SMILES: CN1C=NC2=C(N)N=CN=C12
| Poids moléculaire (g/mol) | 149.16 |
|---|---|
| Synonyme | 9-methyladenine,9-methyl-9h-purin-6-amine,n9-methyladenine,9-methyl-9h-adenine,6-amino-9-methylpurine,9h-purin-6-amine, 9-methyl,adenine, 9-methyl,9-methyl-9h-purin-6-ylamine,ccris 6905,chembl65976 |
| Numéro MDL | MFCD00047232 |
| CAS | 700-00-5 |
| CID PubChem | 69689 |
| ChEBI | CHEBI:40526 |
| Nom IUPAC | 9-methylpurin-6-amine |
| Clé InChI | WRXCXOUDSPTXNX-UHFFFAOYSA-N |
| SMILES | CN1C=NC2=C(N)N=CN=C12 |
| Formule moléculaire | C6H7N5 |
Thermo Scientific Chemicals Adenine, 99%
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 |
3-Isobutyl-1-methylxanthine
CAS: 28822-58-4 Formule moléculaire: C10H14N4O2 Poids moléculaire (g/mol): 222.25 Numéro MDL: MFCD00005584 Clé InChI: APIXJSLKIYYUKG-UHFFFAOYSA-N Synonyme: 3-isobutyl-1-methylxanthine,ibmx,isobutylmethylxanthine,1-methyl-3-isobutylxanthine,methylisobutylxanthine,3-isobutyl-1-methyl-1h-purine-2,6 3h,7h-dione,xanthine, 3-isobutyl-1-methyl,3-isobutyl-1-methyxanthine,1h-purine-2,6-dione, 3,7-dihydro-1-methyl-3-2-methylpropyl,methyl-isobutylxanthine CID PubChem: 3758 ChEBI: CHEBI:43253 Nom IUPAC: 1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione SMILES: CC(C)CN1C2=C(NC=N2)C(=O)N(C)C1=O
| Poids moléculaire (g/mol) | 222.25 |
|---|---|
| Synonyme | 3-isobutyl-1-methylxanthine,ibmx,isobutylmethylxanthine,1-methyl-3-isobutylxanthine,methylisobutylxanthine,3-isobutyl-1-methyl-1h-purine-2,6 3h,7h-dione,xanthine, 3-isobutyl-1-methyl,3-isobutyl-1-methyxanthine,1h-purine-2,6-dione, 3,7-dihydro-1-methyl-3-2-methylpropyl,methyl-isobutylxanthine |
| Numéro MDL | MFCD00005584 |
| CAS | 28822-58-4 |
| CID PubChem | 3758 |
| ChEBI | CHEBI:43253 |
| Nom IUPAC | 1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione |
| Clé InChI | APIXJSLKIYYUKG-UHFFFAOYSA-N |
| SMILES | CC(C)CN1C2=C(NC=N2)C(=O)N(C)C1=O |
| Formule moléculaire | C10H14N4O2 |
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 |
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 |
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 |