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ChEBI
> Main
CHEBI:81928 - Ioxynil octanoate
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ChEBI Ontology
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ChEBI Name
Ioxynil octanoate
ChEBI ID
CHEBI:81928
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This entity has been manually annotated by a third party.
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Formula
C15H17I2NO2
Net Charge
0
Average Mass
497.10990
Monoisotopic Mass
496.93487
InChI
InChI=1S/C15H17I2NO2/c1-2-3-4-5-6-7-14(19)20-15-12(16)8-11(10-18)9-13(15)17/h8-9H,2-7H2,1H3
InChIKey
QBEXFUOWUYCXNI-UHFFFAOYSA-N
SMILES
CCCCCCCC(=O)Oc1c(I)cc(cc1I)C#N
ChEBI Ontology
Outgoing
Ioxynil octanoate (
CHEBI:81928
)
is a
benzoate ester (
CHEBI:36054
)
Ioxynil octanoate (
CHEBI:81928
)
is a
phenols (
CHEBI:33853
)
Manual Xrefs
Databases
1063
PPDB
C18740
KEGG COMPOUND
View more database links
Registry Number
Type
Source
3861-47-0
CAS Registry Number
KEGG COMPOUND