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CHEBI:226433 - TMC-205

ChEBI IDCHEBI:226433
ChEBI NameTMC-205
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FormulaC14H13NO2
Net Charge0
Average Mass227.263
Monoisotopic Mass227.09463
SMILESC=C(C)/C=C/c1ccc2c(C(=O)O)cnc2c1
InChIInChI=1S/C14H13NO2/c1-9(2)3-4-10-5-6-11-12(14(16)17)8-15-13(11)7-10/h3-8,15H,1H2,2H3,(H,16,17)/b4-3+
InChIKeyDGRQZYNJXNNHBY-ONEGZZNKSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
TMC-205 (CHEBI:226433) is a indolyl carboxylic acid (CHEBI:46867)
IUPAC Name 
6-[(1E)-3-methylbuta-1,3-dienyl]-1H-indole-3-carboxylic acid
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7970315ChemSpider