Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(3S,6S,10S,14S,17S,20S,24S,28S,31S,34S,37S,40S,43S,46S,52S)-3-((4S,7S,10S,13S,16S,20S,23S,26S,29S,32S)-13-((1H-indol-3-yl)methyl)-26-(4-aminobutyl)-29-(3-aminopropyl)-4-butyl-32-carbamoyl-23-(3-guanidinopropyl)-10-((R)-1-hydroxyethyl)-7,16-bis(hydroxymethyl)-20-methyl-2,5,8,11,14,17,21,24,27,30,39-undecaoxo-3-oxa-6,9,12,15,18,22,25,28,31,38-decaazatetracontylcarbamoyl)-52-((S)-2-acetamido-4-methylpentanamido)-17-(5-acetamidopentyl)-28,40-bis(4-aminobutyl)-14-sec-butyl-43-(2-carboxyethyl)-34,46-bis(3-guanidinopropyl)-37-isopropyl-6,10,20,24,31-pentamethyl-5,9,13,16,19,23,27,30,33,36,39,42,45,48,51-pentadecaoxo-4,8,12,15,18,22,26,29,32,35,38,41,44,47,50-pentadecaazatetrapentacontane-1,54-dicarboxylic acid
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Canonical SMILES
CCCC[C@H](OC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)CNC(=O)[C@@H](C)CNC(=O)[C@@H](NC(=O)[C@H](CCCCCNC(C)=O)NC(=O)[C@@H](C)CNC(=O)[C@@H](C)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(C)=O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)NC[C@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN)C(=O)N[C@@H](CCCCCNC(C)=O)C(N)=O)[C@@H](C)O
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Compound Formula C147H254N44O41
Compound Structure
Protein Name
 Protein Info 
Relaxin receptor 1
Protein Classification
Membrane receptor
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Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Relaxin-like peptide receptor (family A GPCR)
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Relaxin receptor
Uniprot ID
Q9HBX9
Gene Name
RXFP1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000708 OVCAR-5
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 18 nM
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