Résultats de la recherche filtrée
Neratinib,Thermo Scientific Chemicals
CAS: 698387-09-6 Formule moléculaire: C30H29ClN6O3 Poids moléculaire (g/mol): 557.05 Clé InChI: JWNPDZNEKVCWMY-UHFFFAOYSA-N Nom IUPAC: N-[4-({3-chloro-4-[(pyridine-2-yl)méthoxy]phényl}amino)-3-cyano-7-éthoxyquinoline-6-yl]-4-(diméthylamino)but-2-enamide SMILES: CCOC1=C(NC(=O)C=CCN(C)C)C=C2C(NC3=CC(Cl)=C(OCC4=CC=CC=N4)C=C3)=C(C=NC2=C1)C#N
| Poids moléculaire (g/mol) | 557.05 |
|---|---|
| CAS | 698387-09-6 |
| Nom IUPAC | N-[4-({3-chloro-4-[(pyridine-2-yl)méthoxy]phényl}amino)-3-cyano-7-éthoxyquinoline-6-yl]-4-(diméthylamino)but-2-enamide |
| Clé InChI | JWNPDZNEKVCWMY-UHFFFAOYSA-N |
| SMILES | CCOC1=C(NC(=O)C=CCN(C)C)C=C2C(NC3=CC(Cl)=C(OCC4=CC=CC=N4)C=C3)=C(C=NC2=C1)C#N |
| Formule moléculaire | C30H29ClN6O3 |
Acide DL-6-hydroxy-1,2,3,4-tétrahydroisoquinoléine-3-carboxylique hydraté, 96 %, Thermo Scientific™
CAS: 76824-99-2 Formule moléculaire: C10H11NO3 Poids moléculaire (g/mol): 193.20 Numéro MDL: MFCD03092912 Clé InChI: CRAGDYRHPWTZJL-UHFFFAOYNA-N Synonyme: 6-hydroxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid hydrate,6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrate,akos 68,d,l-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrate,6-hydroxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid h2o,6-oxidanyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrate,d,l-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid CID PubChem: 18525693 SMILES: OC(=O)C1CC2=C(CN1)C=CC(O)=C2
| Poids moléculaire (g/mol) | 193.20 |
|---|---|
| Synonyme | 6-hydroxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid hydrate,6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrate,akos 68,d,l-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrate,6-hydroxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid h2o,6-oxidanyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrate,d,l-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid |
| Numéro MDL | MFCD03092912 |
| CAS | 76824-99-2 |
| CID PubChem | 18525693 |
| Clé InChI | CRAGDYRHPWTZJL-UHFFFAOYNA-N |
| SMILES | OC(=O)C1CC2=C(CN1)C=CC(O)=C2 |
| Formule moléculaire | C10H11NO3 |
Thermo Scientific Chemicals Asiaticoside, +92 %
CAS: 16830-15-2 Formule moléculaire: C48H78O19 Poids moléculaire (g/mol): 959.13 Clé InChI: WYQVAPGDARQUBT-NNUNPJGWSA-N Nom IUPAC: 6-({[3,4-dihydroxy-6-(hydroxyméthyl)-5-[(3,4,5-trihydroxy-6-méthyloxan-2-yl)oxy]oxan-2-yl]oxy}méthyl)-3,4,5-trihydroxyoxan-2-yl (1S,2R,4aS,6aS,6bR,9R,10S,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxyméthyl)-1,2,6a,6b,9,12a-hexaméthyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicène-4a-carboxylate SMILES: C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)OC1OC(COC2OC(CO)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
| Poids moléculaire (g/mol) | 959.13 |
|---|---|
| CAS | 16830-15-2 |
| Nom IUPAC | 6-({[3,4-dihydroxy-6-(hydroxyméthyl)-5-[(3,4,5-trihydroxy-6-méthyloxan-2-yl)oxy]oxan-2-yl]oxy}méthyl)-3,4,5-trihydroxyoxan-2-yl (1S,2R,4aS,6aS,6bR,9R,10S,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxyméthyl)-1,2,6a,6b,9,12a-hexaméthyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicène-4a-carboxylate |
| Clé InChI | WYQVAPGDARQUBT-NNUNPJGWSA-N |
| SMILES | C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)C5CC[C@@]34C)[C@@H]2[C@H]1C)C(=O)OC1OC(COC2OC(CO)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
| Formule moléculaire | C48H78O19 |
2-acétamido-2-désoxy-alpha-D-glucopyranose, 99+%, Thermo Scientific Chemicals
CAS: 10036-64-3 Formule moléculaire: C8H15NO6 Poids moléculaire (g/mol): 221.21 Numéro MDL: MFCD00064359 Clé InChI: OVRNDRQMDRJTHS-PSLNIYNBNA-N Synonyme: n-acetyl-alpha-d-glucosamine,alpha-glcnac,alpha-d-glcnac,2-acetamido-2-deoxy-alpha-d-glucopyranose,unii-t13ti5gh3d,2-acetylamino-2-deoxy-a-d-glucopyranose,t13ti5gh3d,2-acetylamino-2-deoxy-alpha-d-glucopyranose,n-2s,3r,4r,5s,6r-2,4,5-trihydroxy-6-hydroxymethyl oxan-3-yl acetamide,n-2s,3r,4r,5s,6r-2,4,5-trihydroxy-6-hydroxymethyl tetrahydro-2h-pyran-3-yl acetamide CID PubChem: 82313 ChEBI: CHEBI:44278 Nom IUPAC: N-[(2S,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxyméthyl)oxan-3-yl]acétamide SMILES: CC(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O
| Poids moléculaire (g/mol) | 221.21 |
|---|---|
| Synonyme | n-acetyl-alpha-d-glucosamine,alpha-glcnac,alpha-d-glcnac,2-acetamido-2-deoxy-alpha-d-glucopyranose,unii-t13ti5gh3d,2-acetylamino-2-deoxy-a-d-glucopyranose,t13ti5gh3d,2-acetylamino-2-deoxy-alpha-d-glucopyranose,n-2s,3r,4r,5s,6r-2,4,5-trihydroxy-6-hydroxymethyl oxan-3-yl acetamide,n-2s,3r,4r,5s,6r-2,4,5-trihydroxy-6-hydroxymethyl tetrahydro-2h-pyran-3-yl acetamide |
| Numéro MDL | MFCD00064359 |
| CAS | 10036-64-3 |
| CID PubChem | 82313 |
| ChEBI | CHEBI:44278 |
| Nom IUPAC | N-[(2S,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxyméthyl)oxan-3-yl]acétamide |
| Clé InChI | OVRNDRQMDRJTHS-PSLNIYNBNA-N |
| SMILES | CC(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O |
| Formule moléculaire | C8H15NO6 |
Iodure dʼacétylcholine, 99 %, Thermo Scientific Chemicals
CAS: 2260-50-6 Formule moléculaire: C7H16INO2 Poids moléculaire (g/mol): 273.11 Numéro MDL: MFCD00011815 Clé InChI: SMBBQHHYSLHDHF-UHFFFAOYSA-M Synonyme: acetylcholine iodide,acetylcolina,2-acetoxy-n,n,n-trimethylethanaminium iodide,acetylcolina italian,unii-7zcp12s7hq,choline, iodide, acetate ester,2-acetoxyethyl trimethylammonium iodide,7zcp12s7hq,ethanaminium, 2-acetyloxy-n,n,n-trimethyl-, iodide,2-acetyloxy-n,n,n-trimethylethanamium iodide CID PubChem: 75271 SMILES: [I-].CC(=O)OCC[N+](C)(C)C
| Poids moléculaire (g/mol) | 273.11 |
|---|---|
| Synonyme | acetylcholine iodide,acetylcolina,2-acetoxy-n,n,n-trimethylethanaminium iodide,acetylcolina italian,unii-7zcp12s7hq,choline, iodide, acetate ester,2-acetoxyethyl trimethylammonium iodide,7zcp12s7hq,ethanaminium, 2-acetyloxy-n,n,n-trimethyl-, iodide,2-acetyloxy-n,n,n-trimethylethanamium iodide |
| Numéro MDL | MFCD00011815 |
| CAS | 2260-50-6 |
| CID PubChem | 75271 |
| Clé InChI | SMBBQHHYSLHDHF-UHFFFAOYSA-M |
| SMILES | [I-].CC(=O)OCC[N+](C)(C)C |
| Formule moléculaire | C7H16INO2 |
Chlorhydrate d‘ester diéthylique de l‘acide L-glutamique, 98 %, Thermo Scientific™ ™
CAS: 1118-89-4 Formule moléculaire: C9H17NO4·HCl Poids moléculaire (g/mol): 239.7 Clé InChI: WSEQLMQNPBNMSL-FJXQXJEOSA-N Synonyme: l-glutamic acid diethyl ester hydrochloride,diethyl l-glutamate hydrochloride,h-glu oet-oet.hcl,diethyl glutamate hydrochloride,h-glu oet-oet hcl,s-diethyl 2-aminopentanedioate hydrochloride,diethyl l-glutaminate hydrochloride,1,5-diethyl 2s-2-aminopentanedioate hydrochloride,l-glutamic acid, diethyl ester, hydrochloride,diethyl 2s-2-aminopentanedioate hydrochloride CID PubChem: 73960 Nom IUPAC: diéthyle (2S)-2-aminopentanédioate ; chlorhydrate SMILES: CCOC(=O)CCC(C(=O)OCC)N.Cl
| Poids moléculaire (g/mol) | 239.7 |
|---|---|
| Synonyme | l-glutamic acid diethyl ester hydrochloride,diethyl l-glutamate hydrochloride,h-glu oet-oet.hcl,diethyl glutamate hydrochloride,h-glu oet-oet hcl,s-diethyl 2-aminopentanedioate hydrochloride,diethyl l-glutaminate hydrochloride,1,5-diethyl 2s-2-aminopentanedioate hydrochloride,l-glutamic acid, diethyl ester, hydrochloride,diethyl 2s-2-aminopentanedioate hydrochloride |
| CAS | 1118-89-4 |
| CID PubChem | 73960 |
| Nom IUPAC | diéthyle (2S)-2-aminopentanédioate ; chlorhydrate |
| Clé InChI | WSEQLMQNPBNMSL-FJXQXJEOSA-N |
| SMILES | CCOC(=O)CCC(C(=O)OCC)N.Cl |
| Formule moléculaire | C9H17NO4·HCl |
N-acétyl-L-glutamine, 97 %, Thermo Scientific™
CAS: 35305-74-9 Formule moléculaire: C7H12N2O4 Poids moléculaire (g/mol): 188.18 Numéro MDL: MFCD00038159 Clé InChI: KSMRODHGGIIXDV-YFKPBYRVSA-N Synonyme: n-acetyl-l-glutamine,aceglutamide,l-glutamine, n-acetyl,nalpha-acetyl-l-glutamine,s-2-acetamido-5-amino-5-oxopentanoic acid,acetylglutamine,n-alpha-acetyl-l-glutamine,n-acetylglutamine,acutil-s,acetyl-l-glutamine CID PubChem: 182230 ChEBI: CHEBI:21553 SMILES: CC(=O)N[C@@H](CCC(N)=O)C(O)=O
| Poids moléculaire (g/mol) | 188.18 |
|---|---|
| Synonyme | n-acetyl-l-glutamine,aceglutamide,l-glutamine, n-acetyl,nalpha-acetyl-l-glutamine,s-2-acetamido-5-amino-5-oxopentanoic acid,acetylglutamine,n-alpha-acetyl-l-glutamine,n-acetylglutamine,acutil-s,acetyl-l-glutamine |
| Numéro MDL | MFCD00038159 |
| CAS | 35305-74-9 |
| CID PubChem | 182230 |
| ChEBI | CHEBI:21553 |
| Clé InChI | KSMRODHGGIIXDV-YFKPBYRVSA-N |
| SMILES | CC(=O)N[C@@H](CCC(N)=O)C(O)=O |
| Formule moléculaire | C7H12N2O4 |
Thermo Scientific Chemicals Amifostine trihydraté
CAS: 112901-68-5 Formule moléculaire: C5H21N2O6PS Poids moléculaire (g/mol): 268.26 Clé InChI: TXQPXJKRNHJWAX-UHFFFAOYSA-N Nom IUPAC: Acide ({2-[(3-aminopropyl)amino]éthyl}sultanyl)phosphonique trihydraté SMILES: O.O.O.NCCCNCCSP(O)(O)=O
| Poids moléculaire (g/mol) | 268.26 |
|---|---|
| CAS | 112901-68-5 |
| Nom IUPAC | Acide ({2-[(3-aminopropyl)amino]éthyl}sultanyl)phosphonique trihydraté |
| Clé InChI | TXQPXJKRNHJWAX-UHFFFAOYSA-N |
| SMILES | O.O.O.NCCCNCCSP(O)(O)=O |
| Formule moléculaire | C5H21N2O6PS |
Thermo Scientific Chemicals Dichlorhydrate de pramipexole monohydraté, 98 %
CAS: 191217-81-9 Formule moléculaire: C10H21Cl2N3OS Poids moléculaire (g/mol): 302.26 Numéro MDL: MFCD00876894,MFCD02183927 Clé InChI: APVQOOKHDZVJEX-QTPLPEIMSA-N Nom IUPAC: dihydrogen (6S)-N6-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine hydrate dichloride SMILES: [H+].[H+].O.[Cl-].[Cl-].CCCN[C@H]1CCC2=C(C1)SC(N)=N2
| Poids moléculaire (g/mol) | 302.26 |
|---|---|
| Numéro MDL | MFCD00876894,MFCD02183927 |
| CAS | 191217-81-9 |
| Nom IUPAC | dihydrogen (6S)-N6-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine hydrate dichloride |
| Clé InChI | APVQOOKHDZVJEX-QTPLPEIMSA-N |
| SMILES | [H+].[H+].O.[Cl-].[Cl-].CCCN[C@H]1CCC2=C(C1)SC(N)=N2 |
| Formule moléculaire | C10H21Cl2N3OS |
Hydrate d’acide glycocholique, Thermo Scientific™
CAS: 1192657-83-2 Formule moléculaire: C26H43NO6 Poids moléculaire (g/mol): 465.63 Numéro MDL: MFCD06408004 Clé InChI: RFDAIACWWDREDC-MTSIQNSJNA-N Nom IUPAC: Hydrate d’acide 2-(4-{4,7,11-trihydroxy-9a,11a-diméthyl-hexadécahydro-1H-cyclopenta[a]phénanthren-1-yl}pentanamido)acétique SMILES: [H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@]12C)[C@H](C)CCC(=O)NCC(O)=O
| Poids moléculaire (g/mol) | 465.63 |
|---|---|
| Numéro MDL | MFCD06408004 |
| CAS | 1192657-83-2 |
| Nom IUPAC | Hydrate d’acide 2-(4-{4,7,11-trihydroxy-9a,11a-diméthyl-hexadécahydro-1H-cyclopenta[a]phénanthren-1-yl}pentanamido)acétique |
| Clé InChI | RFDAIACWWDREDC-MTSIQNSJNA-N |
| SMILES | [H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@]12C)[C@H](C)CCC(=O)NCC(O)=O |
| Formule moléculaire | C26H43NO6 |
Pseudopelletierine,Thermo Scientific Chemicals
CAS: 552-70-5 Formule moléculaire: C9H15NO Poids moléculaire (g/mol): 153.23 Clé InChI: RHWSKVCZXBAWLZ-UHFFFAOYNA-N Nom IUPAC: 9-méthyl-9-azabicyclo[3.3.1]nonan-3-one SMILES: CN1C2CCCC1CC(=O)C2
| Poids moléculaire (g/mol) | 153.23 |
|---|---|
| CAS | 552-70-5 |
| Nom IUPAC | 9-méthyl-9-azabicyclo[3.3.1]nonan-3-one |
| Clé InChI | RHWSKVCZXBAWLZ-UHFFFAOYNA-N |
| SMILES | CN1C2CCCC1CC(=O)C2 |
| Formule moléculaire | C9H15NO |
N-Carbobenzyloxyglycine, 98,5 %, Thermo Scientific Chemicals
CAS: 1138-80-3 Numéro MDL: MFCD00002691 Clé InChI: CJUMAFVKTCBCJK-UHFFFAOYSA-N Synonyme: n-carbobenzyloxyglycine,n-cbz-glycine,z-gly-oh,carbobenzyloxyglycine,carbobenzoxyglycine,n-benzyloxycarbonylglycine,n-carbobenzoxyglycine,cbz-gly-oh,cbz gly,benzyloxycarbonylglycine CID PubChem: 14349 ChEBI: CHEBI:16532 Nom IUPAC: Acide 2-(phénylméthoxycarbonylamino)acétique SMILES: C1=CC=C(C=C1)COC(=O)NCC(=O)O
| Synonyme | n-carbobenzyloxyglycine,n-cbz-glycine,z-gly-oh,carbobenzyloxyglycine,carbobenzoxyglycine,n-benzyloxycarbonylglycine,n-carbobenzoxyglycine,cbz-gly-oh,cbz gly,benzyloxycarbonylglycine |
|---|---|
| Numéro MDL | MFCD00002691 |
| CAS | 1138-80-3 |
| CID PubChem | 14349 |
| ChEBI | CHEBI:16532 |
| Nom IUPAC | Acide 2-(phénylméthoxycarbonylamino)acétique |
| Clé InChI | CJUMAFVKTCBCJK-UHFFFAOYSA-N |
| SMILES | C1=CC=C(C=C1)COC(=O)NCC(=O)O |