SpectraBase Compound ID | IRdbbPAnhXd |
---|---|
InChI | InChI=1S/C42H51N7O4.ClH/c43-24-14-13-23-36(41(52)44-26-33-17-7-2-8-18-33)46-39(50)30-48-31-40(51)49(28-35-21-11-4-12-22-35)29-38(48)37(25-32-15-5-1-6-16-32)47-42(53)45-27-34-19-9-3-10-20-34;/h1-12,15-22,36-38H,13-14,23-31,43H2,(H,44,52)(H,46,50)(H2,45,47,53);1H/t36?,37-,38+;/m0./s1 |
InChIKey | IPWLXGLKKLRJDR-XIVJZRBJSA-N |
Mol Weight | 754.4 g/mol |
Molecular Formula | C42H52ClN7O4 |
Exact Mass | 753.376931 g/mol |
Parent InChIKey | RCZUYPXKHSHAOJ-GGJINPDOSA-N |
Enantiomer InChIKey | IPWLXGLKKLRJDR-DBPPBONZSA-N |
Title | Journal or Book | Year |
---|---|---|
Exploring the Phe-Gly Dipeptide-Derived Piperazinone Scaffold in the Search for Antagonists of the Thrombin Receptor PAR1 | Molecules | 2014 |
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