CHEBI:81914 - Dinobuton

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ChEBI Name Dinobuton
ChEBI ID CHEBI:81914
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C14H18N2O7
Net Charge 0
Average Mass 326.30190
Monoisotopic Mass 326.11140
InChI InChI=1S/C14H18N2O7/c1-5-9(4)11-6-10(15(18)19)7-12(16(20)21)13(11)23-14(17)22-8(2)3/h6-9H,5H2,1-4H3
InChIKey HDWLUGYOLUHEMN-UHFFFAOYSA-N
SMILES CCC(C)c1cc(cc(c1OC(=O)OC(C)C)[N+]([O-])=O)[N+]([O-])=O
ChEBI Ontology
Outgoing Dinobuton (CHEBI:81914) is a C-nitro compound (CHEBI:35716)
Manual Xrefs Databases
249 PPDB
C18721 KEGG COMPOUND
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Registry Number Type Source
973-21-7 CAS Registry Number KEGG COMPOUND