Brief Information of the Compound and Protein
Compound Name
(2S)-2-acetamido-N-[(3S,10S,13R,16S,19S,22S,25S)-10-[3-(diaminomethylideneamino)propyl]-13,16,19-trimethyl-22-(2-methylpropyl)-2,9,12,15,18,21,24-heptaoxo-1,8,11,14,17,20,23-heptazabicyclo[23.3.0]octacosan-3-yl]-3-phenylpropanamide
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PubChem ID
CID: 166631567
Canonical SMILES
CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC1=O)NC(=O)[C@H](Cc1ccccc1)NC(C)=O
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Compound Formula C43H68N12O9
Compound Structure
Protein Name
C5a anaphylatoxin chemotactic receptor 1
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Anaphylatoxin receptor family
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Anaphylatoxin receptor
Uniprot ID
P21730
Gene Name
C5AR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
EC50 > 100000 nM
   TI
   LI
   LO
   TS