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ConjuPepDB ID: cpd00791

Chemical structure


molecule
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cpd00791


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
XARPAK b-carboline alkaloid
Identification
ConjuPepDB ID

cpd00791

Smiles
Inchi Key

InChIKey=MQOHPEIAGQZXIM-HCYASMGOSA-N

Molecular weight

845.455

Molecular formula

C42H59N11O8

Chemical name
Peptide information
Sequence (one letter)

XARPAK

Length

6

Peptide name

pentapeptide generated by plasmin degradation from the fibrinogen beta chain

External ID
CAS number

1305119-03-2

Other information
Application

Anti-thrombolytic therapy

Additional function

Free radical scavenging and thrombolitic activity, protective effect against organ injury induced by I/R in rat

Conjugate type

amide

Linker

no

Small molecule

b-carboline alkaloid

Small molecule CAS

519032-21-4

Small molecule structure

NMR solvent

CD3OD + TFA

Calculated properties
LogP

-2.69810

Rotatable bonds

20

H bond donor

10

H bond acceptor

13

Polar surface area (PSA)

301.48000

Citations
ID Title Year Authors Journal DOI

Cpdart0119

A new class of β-carboline alkaloid-peptide conjugates with therapeutic efficacy in acute limb ischemia/reperfusion injury

2011

Bi, Wei; Bi, Yue; Xue, Ping; Zhang, Yanrong; Gao, Xiang; Wang, Zhibo; Li, Meng; Baudy-Floc'h, Michele; Ngerebara, Nathaniel; Michael Gibson, K.; Bi, Lanrong

European Journal of Medicinal Chemistry

..