Products 124431-80-7

CAS 124431-80-7 appears in our catalog under these names: CGS 21680A, >95% (HPLC), CGS 21680 HCl, CGS 21680 Hydrochloride/ 98.81% (existing batch purity), CGS 21680 HCl, CGS 21680 Hydrochloride, >95.0%(HPLC)(qNMR). Offered by: TRC, GLPBio, TargetMol, Biosynth, TCI. Available pack sizes: 10mg, 5mg, 100mg, 50mg, 1mg, 2mg, 25mg, 250mg.

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

3-[4-[2-[[6-amino-9-[(2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]amino]ethyl]phenyl]propanoic acid;hydrochloride (CAS 124431-80-7) is a chemical compound with the molecular formula C23H30ClN7O6 and a molecular weight of 536.0 g/mol. IUPAC name: 3-[4-[2-[[6-amino-9-[(2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]amino]ethyl]phenyl]propanoic acid;hydrochloride. InChIKey: QPHVMNOEKKJYJO-MJWSIIAUSA-N.

Identity
Molecular formulaC23H30ClN7O6
Molecular weight536.0 g/mol
IUPAC name3-[4-[2-[[6-amino-9-[(2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]amino]ethyl]phenyl]propanoic acid;hydrochloride
InChIKeyQPHVMNOEKKJYJO-MJWSIIAUSA-N
SMILESCCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=C(N=C32)NCCC4=CC=C(C=C4)CCC(=O)O)N)O)O.Cl

Computed by PubChem (NCBI)