CHEBI:82167 - Dinex

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Dinex
ChEBI ID CHEBI:82167
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C12H14N2O5
Net Charge 0
Average Mass 266.25000
Monoisotopic Mass 266.09027
InChI InChI=1S/C12H14N2O5/c15-12-10(8-4-2-1-3-5-8)6-9(13(16)17)7-11(12)14(18)19/h6-8,15H,1-5H2
InChIKey QJYHUJAGJUHXJN-UHFFFAOYSA-N
SMILES Oc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)C1CCCCC1
ChEBI Ontology
Outgoing Dinex (CHEBI:82167) is a alkylbenzene (CHEBI:38976)
Dinex (CHEBI:82167) is a ring assembly (CHEBI:36820)
Manual Xrefs Databases
2760 PPDB
C19038 KEGG COMPOUND
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Registry Number Type Source
131-89-5 CAS Registry Number KEGG COMPOUND