CHEBI:31700 - Iobenzamic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Iobenzamic acid
ChEBI ID CHEBI:31700
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C16H13I3N2O3
C16H13I3N2O3
Net Charge 0
Average Mass 662.000
Monoisotopic Mass 661.80603
InChI InChI=1S/C16H13I3N2O3/c17-10-8-11(18)15(20)14(19)13(10)16(24)21(7-6-12(22)23)9-4-2-1-3-5-9/h1-5,8H,6-7,20H2,(H,22,23)
InChIKey FJYJNLIEGUTPIJ-UHFFFAOYSA-N
SMILES C(N(CCC(O)=O)C1=CC=CC=C1)(=O)C2=C(I)C(N)=C(C=C2I)I
ChEBI Ontology
Outgoing Iobenzamic acid (CHEBI:31700) is a organic molecular entity (CHEBI:50860)
Synonym Source
Iobenzamic acid KEGG COMPOUND
Manual Xrefs Databases
3759 DrugCentral
D01313 KEGG DRUG
View more database links
Registry Number Type Source
3115-05-7 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017