Cangrelor

cas: 163706-06-7 — see every product listed under this CAS number, including other names

Cangrelor (CAS 163706-06-7) is a chemical reagent available from Chemat. Available pack sizes: 100mg, Get quote. Offered by: TRC, MedChemExpress.

brandTRC
catalog numberTRC-C175230-100MG
cas163706-06-7
size100mg
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properties

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delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

Cangrelor is a nucleoside triphosphate analogue that is 5'-O-[({[dichloro(phosphono)methyl](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]adenosine carrying additional 2-(methylsulfanyl)ethyl and (3,3,3-trifluoropropyl)sulfanyl substituents at positions N6 and C2 respectively. Used (in the form of its tetrasodium salt) as an intravenous antiplatelet drug that prevents formation of harmful blood clots in the coronary arteries. It has a role as a platelet aggregation inhibitor and a P2Y12 receptor antagonist. It is an aryl sulfide, an organochlorine compound, an adenosine 5'-phosphate, an organofluorine compound, a nucleoside triphosphate analogue and a secondary amino compound. It is a conjugate acid of a cangrelor(4-).

Source: ChEBI

Identity
Molecular formulaC17H25Cl2F3N5O12P3S2
Molecular weight776.4 g/mol
IUPAC name[dichloro-[[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-(2-methylsulfanylethylamino)-2-(3,3,3-trifluoropropylsulfanyl)purin-9-yl]oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methyl]phosphonic acid
InChIKeyPAEBIVWUMLRPSK-IDTAVKCVSA-N
SMILESCSCCNC1=C2C(=NC(=N1)SCCC(F)(F)F)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(C(P(=O)(O)O)(Cl)Cl)O)O)O

Computed by PubChem (NCBI)

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