Products 2920695-77-6

CAS 2920695-77-6 is the registry number for KRAS inhibitor-31, 99.36%. Offered by: MedChemExpress. Available pack sizes: 10 mg, 100 mg, 5 mg, 25 mg, 50 mg.

Structural formula: {0} (CAS {1})

5-ethynyl-6-fluoro-4-[(8S)-14-fluoro-17-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-6,10-dioxa-2,12,16,18-tetrazatetracyclo[9.7.1.02,8.015,19]nonadeca-1(18),11,13,15(19),16-pentaen-13-yl]naphthalen-2-ol (CAS 2920695-77-6) is a chemical compound with the molecular formula C33H30F3N5O4 and a molecular weight of 617.6 g/mol. IUPAC name: 5-ethynyl-6-fluoro-4-[(8S)-14-fluoro-17-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-6,10-dioxa-2,12,16,18-tetrazatetracyclo[9.7.1.02,8.015,19]nonadeca-1(18),11,13,15(19),16-pentaen-13-yl]naphthalen-2-ol. InChIKey: LWYZDHJRUISMAW-FSSPWDJASA-N.

Identity
Molecular formulaC33H30F3N5O4
Molecular weight617.6 g/mol
IUPAC name5-ethynyl-6-fluoro-4-[(8S)-14-fluoro-17-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-6,10-dioxa-2,12,16,18-tetrazatetracyclo[9.7.1.02,8.015,19]nonadeca-1(18),11,13,15(19),16-pentaen-13-yl]naphthalen-2-ol
InChIKeyLWYZDHJRUISMAW-FSSPWDJASA-N
SMILESC#CC1=C(C=CC2=CC(=CC(=C21)C3=C(C4=C5C(=NC(=N4)OC[C@@]67CCCN6C[C@@H](C7)F)N8CCCOC[C@H]8COC5=N3)F)O)F

Computed by PubChem (NCBI)