5-Desthiopropyl-5-hydroxy-ticagrelor
Product Code
TRC-D297505
CAS Number
Product Format
Neat
Molecular Formula
C20 H22 F2 N6 O5
Molecular Weight
464.42
Product Categories
Drug derivatives & metabolites, TRC, Purinergic P2Y receptors, Pain and Inflammation
Product Type
MetabolitePurity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
5-Desthiopropyl-5-hydroxy-ticagrelor
CAS Number
1644461-81-3
Molecular Formula
C20 H22 F2 N6 O5
Molecular Weight
464.42
Accurate Mass
464.162
SMILES
OCCO[C@H]1C[C@H]([C@H](O)[C@@H]1O)n2nnc3c(N[C@@H]4C[C@H]4c5ccc(F)c(F)c5)nc(O)nc23
InChI
InChI=1S/C20H22F2N6O5/c21-10-2-1-8(5-11(10)22)9-6-12(9)23-18-15-19(25-20(32)24-18)28(27-26-15)13-7-14(33-4-3-29)17(31)16(13)30/h1-2,5,9,12-14,16-17,29-31H,3-4,6-7H2,(H2,23,24,25,32)/t9-,12+,13+,14-,16-,17+/m0/s1
IUPAC
(1S,2S,3R,5S)-3-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-hydroxy-triazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol
Product Data
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
Purity
>95% (HPLC)