CHEBI:9572 - Thiourocanic acid

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ChEBI Name Thiourocanic acid
ChEBI ID CHEBI:9572
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C6H6N2O2S
Net Charge 0
Average Mass 170.190
Monoisotopic Mass 170.01500
InChI InChI=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+
InChIKey ZBKFFCZXHBPGFK-OWOJBTEDSA-N
SMILES OC(=O)\C=C\c1c[nH]c(=S)[nH]1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 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 acid KEGG COMPOUND
Manual Xref Database
C05571 KEGG COMPOUND
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Last Modified
20 December 2017