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CHEBI:183978 - 1h-indole-3-carboxylic acid, 1-[(4-fluorophenyl)methyl]-, 1-naphthalenyl ester

ChEBI IDCHEBI:183978
ChEBI Name1h-indole-3-carboxylic acid, 1-[(4-fluorophenyl)methyl]-, 1-naphthalenyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H18FNO2
Net Charge0
Average Mass395.433
Monoisotopic Mass395.13216
SMILESO=C(Oc1cccc2ccccc12)c1cn(Cc2ccc(F)cc2)c2ccccc12
InChIInChI=1S/C26H18FNO2/c27-20-14-12-18(13-15-20)16-28-17-23(22-9-3-4-10-24(22)28)26(29)30-25-11-5-7-19-6-1-2-8-21(19)25/h1-15,17H,16H2
InChIKeyRCEKSVIFQKKFLS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) small intestine (BTO:0000651) MetaboLights (MTBLS3486) Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424]
Nippostrongylus brasiliensis (ncbitaxon:27835) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3486)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
1h-indole-3-carboxylic acid, 1-[(4-fluorophenyl)methyl]-, 1-naphthalenyl ester (CHEBI:183978) is a indolyl carboxylic acid (CHEBI:46867)
IUPAC Name 
naphthalen-1-yl 1-[(4-luorophenyl)methyl]indole-3-carboxylate
Manual XrefsDatabases
29763739ChemSpider