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CHEBI:177197 - L-803087

ChEBI IDCHEBI:177197
ChEBI NameL-803087
Stars
DefinitionA fluoroindole that is 1H-indole substituted by phenyl, 4-{[(2S)-5-carbamimidamido-1-methoxy-1-oxopentan-2-yl]amino}-4-oxobutyl, fluoro and fluoro groups at positions 2, 3, 5 and 7, respectively. It is a selective nonpeptidic agonist of the somatostatin subtype-4 (SST4) receptor with Ki of 0.7 nM.
Secondary ChEBI IDCHEBI:91648
Last Modified5 August 2021
SubmitterSandra Orchard
DownloadsMolfile
FormulaC25H29F2N5O3
Net Charge0
Average Mass485.535
Monoisotopic Mass485.22385
SMILESCOC(=O)[C@H](CCCNC(=N)N)NC(=O)CCCc1c(-c2ccccc2)nc2c(F)cc(F)cc12
InChIInChI=1S/C25H29F2N5O3/c1-35-24(34)20(10-6-12-30-25(28)29)31-21(33)11-5-9-17-18-13-16(26)14-19(27)23(18)32-22(17)15-7-3-2-4-8-15/h2-4,7-8,13-14,20,32H,5-6,9-12H2,1H3,(H,31,33)(H4,28,29,30)/t20-/m0/s1
InChIKeyOPNMQSFIGUSHDH-FQEVSTJZSA-N
Roles Classification
Biological Role:
somatostatin receptor agonist  An agonist that binds to and activates somatostatin receptors.
ChEBI Ontology
Outgoing Relation(s)
L-803087 (CHEBI:177197) has role somatostatin receptor agonist (CHEBI:177023)
L-803087 (CHEBI:177197) is a L-arginine derivative (CHEBI:83965)
L-803087 (CHEBI:177197) is a benzenes (CHEBI:22712)
L-803087 (CHEBI:177197) is a fluoroindole (CHEBI:131960)
L-803087 (CHEBI:177197) is a guanidines (CHEBI:24436)
L-803087 (CHEBI:177197) is a methyl ester (CHEBI:25248)
L-803087 (CHEBI:177197) is a phenylindole (CHEBI:48559)
L-803087 (CHEBI:177197) is a secondary carboxamide (CHEBI:140325)
IUPAC Name 
methyl N2-[4-(5,7-difluoro-2-phenyl-1H-indol-3-yl)butanoyl]-L-argininate
Synonyms  Source
methyl (2S)-5-carbamimidamido-2-[4-(5,7-difluoro-2-phenyl-1H-indol-3-yl)butanamido]pentanoateIUPAC
L 803087ChEBI
L803087ChEBI
L-803,087ChEBI
N2-[4-(5,7-difluoro-2-phenyl-1H-indol-3-yl)-1-oxobutyl]-L-arginine methyl esterChEBI
Manual XrefsDatabases
LSM-1482LINCS
4470867ChemSpider
Registry NumbersSources
CAS:217480-26-7SUBMITTER
Citations