CHEBI:135862 - tyropanoate

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ChEBI Name tyropanoate
ChEBI ID CHEBI:135862
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H18I3NO3
Net Charge 0
Average Mass 641.022
Monoisotopic Mass 640.84208
InChI InChI=1S/C15H18I3NO3/c1-3-5-12(20)19-14-11(17)7-10(16)9(13(14)18)6-8(4-2)15(21)22/h7-8H,3-6H2,1-2H3,(H,19,20)(H,21,22)
InChIKey YMOXVLQZFAUUKI-UHFFFAOYSA-N
SMILES C(C(C(O)=O)CC)C1=C(I)C(NC(CCC)=O)=C(C=C1I)I
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing tyropanoate (CHEBI:135862) is a benzenes (CHEBI:22712)
tyropanoate (CHEBI:135862) is a monocarboxylic acid (CHEBI:25384)
Synonyms Sources
tyropanoate sodium DrugCentral
tyropanoic acid DrugCentral
Manual Xref Database
2785 DrugCentral
View more database links
Registry Number Type Source
27293-82-9 CAS Registry Number DrugCentral
Last Modified
23 February 2017