3D model is for representation purpose only.
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XNFW | beta-carboline derivative |
Identification | |
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ConjuPepDB ID | cpd00749 |
Smiles | |
Inchi Key | InChIKey=IYDHXHJTVYZNIX-KRCBVYEFSA-N |
Molecular weight | 663.281 |
Molecular formula | C36H37N7O6 |
Chemical name | Peptide information |
Sequence (one letter) | XNFW |
Length | 4 |
Peptide name | tripeptide |
External ID | |
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CAS number | 1310735-91-1 |
Other information | |
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Application | Anti-inflammatoric- and analgesic therapy |
Additional function | Analgesic activity and protective effect against mesenteric I/R injury in the rat |
Conjugate type | amide |
Linker | no |
Small molecule | beta-carboline derivative |
Small molecule CAS | 66863-43-2 |
Small molecule structure | |
Structure method | 1H-NMR |
NMR solvent | CDCl3 |
Calculated properties | |
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LogP | -0.82462 |
Rotatable bonds | 13 |
H bond donor | 8 |
H bond acceptor | 7 |
Polar surface area (PSA) | 211.30000 |
Citations | |||||
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ID | Title | Year | Authors | Journal | DOI |
Novel β-carboline-tripeptide conjugates attenuate mesenteric ischemia/reperfusion injury in the rat | 2011 | Bi, Wei; Bi, Yue; Xue, Ping; Zhang, Yanrong; Gao, Xiang; Wang, Zhibo; Li, Meng; Baudy-Floc'h, Michele; Ngerebara, Nathaniel; Li, Xiaoxu; Gibson, K. Michael; Bi, Lanrong | European Journal of Medicinal Chemistry |