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CHEBI:9572 - Thiourocanic acid

ChEBI IDCHEBI:9572
ChEBI NameThiourocanic acid
Stars
Last Modified20 December 2017
DownloadsMolfile
FormulaC6H6N2O2S
Net Charge0
Average Mass170.193
Monoisotopic Mass170.01500
SMILESO=C(O)/C=C/c1cnc(=S)n1
InChIInChI=1S/C6H6N2O2S/c9-5(10)2-1-4-3-7-6(11)8-4/h1-3H,(H,9,10)(H2,7,8,11)/b2-1+
InChIKeyZBKFFCZXHBPGFK-OWOJBTEDSA-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)
Thiourocanic acid (CHEBI:9572) is a 1,3-dihydroimidazole-2-thiones (CHEBI:139340)
Thiourocanic acid (CHEBI:9572) is a monocarboxylic acid (CHEBI:25384)
Synonym  Source
Thiourocanic acidKEGG COMPOUND
Manual XrefsDatabases
C05571KEGG COMPOUND