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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H25N6O8P
Molecular Weight 532.4431
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of REGRELOR

SMILES

CCNC(=O)NC1=C2N=CN([C@@H]3O[C@H](COP(O)(O)=O)[C@H]4O[C@@H](O[C@@H]34)\C=C\C5=CC=CC=C5)C2=NC=N1

InChI

InChIKey=NXHAXEBZOXCDKD-XIXRRVGJSA-N
InChI=1S/C22H25N6O8P/c1-2-23-22(29)27-19-16-20(25-11-24-19)28(12-26-16)21-18-17(14(34-21)10-33-37(30,31)32)35-15(36-18)9-8-13-6-4-3-5-7-13/h3-9,11-12,14-15,17-18,21H,2,10H2,1H3,(H2,30,31,32)(H2,23,24,25,27,29)/b9-8+/t14-,15+,17-,18-,21-/m1/s1

HIDE SMILES / InChI

Description

Regrelor (INS50589) is a P2Y(12) ADP-receptor antagonist that regulates platelet function. Regrelor was found to be well-tolerated and have reversible effects. Its potential therapeutic utility in various cardiovascular settings has been studied. Initial results of canine models suggested that regrelor should be effective in protecting platelet function and reducing blood loss in human patients undergoing open-heart surgery. A phase II study testing regrelor for its safety and efficacy in reduction of postoperative bleeding and blood product transfusion was terminated due to adverse effects.

Approval Year

PubMed