Brief Information of the Compound and Protein
Compound Name
(3S,6S,9S,12S,15S,18S)-18-((S)-2-((S)-2-acetamido-3-(1H-imidazol-5-yl)propanamido)-3-hydroxypropanamido)-9-benzyl-3-((3S,6S,9S,12S,15S,18S,21S,24S)-1,27-diamino-24-((1S,2S)-2-((2S)-1-((2S)-1-((2S)-6-amino-1-((3R,4S)-4-((2S)-1-((2S)-1-((1S,2S)-2-((6S,9S,16S,19S,22S)-1-amino-13-(2-amino-2-oxoethyl)-9,16-bis(4-aminobutyl)-19-sec-butyl-6-((S)-1-carboxy-2-(4-hydroxyphenyl)ethylcarbamoyl)-23-hydroxy-1-imino-8,11,15,18,21-pentaoxo-2,7,10,14,17,20-hexaazatricosan-22-ylcarbamoyl)cyclopentylamino)-4-methyl-1-oxopentan-2-ylamino)-3-(4-hydroxyphenyl)-1-oxopropan-2-ylcarbamoyl)pyrrolidin-3-ylamino)-1-oxohexan-2-ylamino)-1-oxopropan-2-ylamino)-1-oxopropan-2-ylcarbamoyl)cyclopentylcarbamoyl)-21-(4-aminobutyl)-12,18-bis(3-guanidinopropyl)-6-(4-hydroxybenzyl)-9-((R)-1-hydroxyethyl)-15-isobutyl-1,4,7,10,13,16,19,22,27-nonaoxo-5,8,11,14,17,20,23-heptaazaheptacosan-3-ylcarbamoyl)-6-((R)-1-hydroxyethyl)-12-isopropyl-15-methyl-5,8,11,14,17-pentaoxo-4,7,10,13,16-pentaazaicosane-1,20-dioic acid
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PubChem ID
CID: 145993953
Canonical SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H]1CCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H]1CNC[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H]1CCC[C@@H]1NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cnc[nH]1)NC(C)=O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)NC(CC(N)=O)CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O
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Compound Formula C171H270N50O47
Compound Structure
Protein Name
Vasoactive intestinal polypeptide receptor 1
Protein Classification
Membrane receptor
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Family B G protein-coupled receptor
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Peptide receptor (family B GPCR)
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Vasoactive intestinal peptide receptor
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Vasoactive intestinal peptide receptor
Uniprot ID
P32241
Gene Name
VIPR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1 Cricetulus griseus (Chinese hamster)  1
1
EC50 = 0.1952 nM
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