Products 59259-77-7

CAS 59259-77-7 is the registry number for 8-Br-ADPR. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

[[(2R,3S,4R,5R)-5-(6-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4R)-2,3,4-trihydroxy-5-oxopentyl] hydrogen phosphate (CAS 59259-77-7) is a chemical compound with the molecular formula C15H22BrN5O14P2 and a molecular weight of 638.21 g/mol. IUPAC name: [[(2R,3S,4R,5R)-5-(6-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4R)-2,3,4-trihydroxy-5-oxopentyl] hydrogen phosphate. InChIKey: LXVHRMADRNRLNR-ZVIMGNLFSA-N.

Identity
Molecular formulaC15H22BrN5O14P2
Molecular weight638.21 g/mol
IUPAC name[[(2R,3S,4R,5R)-5-(6-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4R)-2,3,4-trihydroxy-5-oxopentyl] hydrogen phosphate
InChIKeyLXVHRMADRNRLNR-ZVIMGNLFSA-N
SMILESC1=NC(=C2C(=N1)N(C(=N2)Br)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OC[C@H]([C@H]([C@H](C=O)O)O)O)O)O)N

Computed by PubChem (NCBI)

Synonyms: orb2646043