Brief Information of the Compound and Protein
Compound Name
(4S,7S,11S,15S,18S,21S,24S,27S,30S,33S,36S,42S)-4-((4S,7S,10S,13S,16S,20S,23S,26S,29S)-13-((1H-indol-3-yl)methyl)-33-amino-26-(4-aminobutyl)-29-carbamoyl-23-(3-guanidinopropyl)-10-((R)-1-hydroxyethyl)-7,16-bis(hydroxymethyl)-20-methyl-4-(2-(methylthio)ethyl)-2,5,8,11,14,17,21,24,27-nonaoxo-3,6,9,12,15,18,22,25,28-nonaazatritriacontylcarbamoyl)-42-((S)-2-acetamido-4-methylpentanamido)-18-(3-amino-3-oxopropyl)-30-(4-aminobutyl)-15-sec-butyl-33-(2-carboxyethyl)-24,36-bis(3-guanidinopropyl)-27-isopropyl-7,11,21-trimethyl-6,10,14,17,20,23,26,29,32,35,38,41-dodecaoxo-5,9,13,16,19,22,25,28,31,34,37,40-dodecaazapentatetracontane-1,45-dioic acid
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Canonical SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)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(=O)NC[C@H](C)C(=O)NC[C@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCSC)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](CCCCN)C(N)=O)[C@@H](C)O
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Compound Formula C120H205N39O35S
Compound Structure
Protein Name
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 Homo sapiens (Human)  1
1
EC50 = 14 nM
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