CAS 3076211-50-9 is the registry number for KRAS-IN-51. Offered by: MedChemExpress. Available pack sizes: Get quote.
(5'S,7S)-2'-amino-2-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-4-[(2R)-2-(hydroxymethyl)-2-methylazetidin-1-yl]-5'-methylspiro[5,8-dihydropyrano[4,3-d]pyrimidine-7,8'-6,7-dihydro-5H-naphthalene]-1'-carbonitrile (CAS 3076211-50-9) is a chemical compound with the molecular formula C31H39FN6O3 and a molecular weight of 562.7 g/mol. IUPAC name: (5'S,7S)-2'-amino-2-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-4-[(2R)-2-(hydroxymethyl)-2-methylazetidin-1-yl]-5'-methylspiro[5,8-dihydropyrano[4,3-d]pyrimidine-7,8'-6,7-dihydro-5H-naphthalene]-1'-carbonitrile. InChIKey: HRTYKBHLPJAKIA-ANECNKCISA-N.
| Molecular formula | C31H39FN6O3 |
|---|---|
| Molecular weight | 562.7 g/mol |
| IUPAC name | (5'S,7S)-2'-amino-2-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-4-[(2R)-2-(hydroxymethyl)-2-methylazetidin-1-yl]-5'-methylspiro[5,8-dihydropyrano[4,3-d]pyrimidine-7,8'-6,7-dihydro-5H-naphthalene]-1'-carbonitrile |
| InChIKey | HRTYKBHLPJAKIA-ANECNKCISA-N |
| SMILES | C[C@H]1CC[C@]2(CC3=C(CO2)C(=NC(=N3)OC[C@@]45CCCN4C[C@@H](C5)F)N6CC[C@]6(C)CO)C7=C1C=CC(=C7C#N)N |
Computed by PubChem (NCBI)