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CHEBI:183777 - ethyl 5-methoxy-2-methyl-1-phenyl-1H-indole-3-carboxylate

ChEBI IDCHEBI:183777
ChEBI Nameethyl 5-methoxy-2-methyl-1-phenyl-1H-indole-3-carboxylate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H19NO3
Net Charge0
Average Mass309.365
Monoisotopic Mass309.13649
SMILESCCOC(=O)c1c(C)n(-c2ccccc2)c2ccc(OC)cc12
InChIInChI=1S/C19H19NO3/c1-4-23-19(21)18-13(2)20(14-8-6-5-7-9-14)17-11-10-15(22-3)12-16(17)18/h5-12H,4H2,1-3H3
InChIKeyQJUANFLACZTKLM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
ethyl 5-methoxy-2-methyl-1-phenyl-1H-indole-3-carboxylate (CHEBI:183777) is a indolyl carboxylic acid (CHEBI:46867)
IUPAC Name 
ethyl 5-methoxy-2-methyl-1-phenylindole-3-carboxylate
Manual XrefsDatabases
545573ChemSpider