CHEBI:32273 - Tyropanoate sodium

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Tyropanoate sodium
ChEBI ID CHEBI:32273
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C15H17I3NNaO3
C15H17I3NO3.Na
Net Charge 0
Average Mass 663.004
Monoisotopic Mass 662.82402
InChI InChI=1S/C15H18I3NO3.Na/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);/q;+1/p-1
InChIKey KTVKGXZZBQCBGD-UHFFFAOYSA-M
SMILES [Na+].N(C=1C(=C(C(=CC1I)I)CC(C(=O)[O-])CC)I)C(=O)CCC
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 sodium (CHEBI:32273) is a benzenes (CHEBI:22712)
Tyropanoate sodium (CHEBI:32273) is a monocarboxylic acid (CHEBI:25384)
Synonym Source
Tyropanoate sodium KEGG COMPOUND
Manual Xref Database
D01884 KEGG DRUG
View more database links
Registry Number Type Source
7246-21-1 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017