2-Chloro-6-amino-9-(2’,3’,5’-tri-O-acetyl-beta-D-ribofuranosyl)purine, >95% (HPLC)

cas: 79999-39-6 — see every product listed under this CAS number, including other names

2-Chloro-6-amino-9-(2’,3’,5’-tri-O-acetyl-beta-D-ribofuranosyl)purine, >95% (HPLC) (CAS 79999-39-6) is a chemical reagent available from Chemat. Available pack sizes: 1g. Offered by: TRC.

• 2D
• 3D

[(2R,3S,4S,5R)-3,4-diacetyloxy-5-(6-amino-2-chloropurin-9-yl)oxolan-2-yl]methyl acetate (CAS 79999-39-6) is a chemical compound with the molecular formula C16H18ClN5O7 and a molecular weight of 427.8 g/mol. IUPAC name: [(2R,3S,4S,5R)-3,4-diacetyloxy-5-(6-amino-2-chloropurin-9-yl)oxolan-2-yl]methyl acetate. InChIKey: IMTFOTCIQPKKSP-CKRXIKOQSA-N.

Identity

Molecular formula	C16H18ClN5O7
Molecular weight	427.8 g/mol
IUPAC name	[(2R,3S,4S,5R)-3,4-diacetyloxy-5-(6-amino-2-chloropurin-9-yl)oxolan-2-yl]methyl acetate
InChIKey	IMTFOTCIQPKKSP-CKRXIKOQSA-N
SMILES	CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@@H](O1)N2C=NC3=C(N=C(N=C32)Cl)N)OC(=O)C)OC(=O)C

Computed by PubChem (NCBI)

Synonyms: 2-Chloro-6-amino-9-(2',3',5'-tri-O-acetyl-beta-D-ribofuranosyl)purine, 2',3',5-Tri-O-acetyl-2-chloroadenosine, Regadenoson Impurity N2, 6-Amino-2-chloro-9-(2',3',5'-tri-O-acetyl-b-D-ribofuranosyl)purine, 2-Chloro-adenosine 2',3',5'-Triacetate, 2-Chloro-6-amino-9-(2',3', 5'-tri-O-acetyl-b-D-ribofuranosyl)purine

Isomers (same molecular formula)

[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(2-amino-6-chloropurin-9-yl)oxolan-2-yl]methyl acetate C₁₆H₁₈ClN₅O₇