CHEBI:31326 - Butoctamide hydrogen succinate

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ChEBI Name Butoctamide hydrogen succinate
ChEBI ID CHEBI:31326
Stars This entity has been manually annotated by a third party.
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Formula C16H29NO5
Net Charge 0
Average Mass 315.406
Monoisotopic Mass 315.20457
InChI InChI=1S/C16H29NO5/c1-4-6-7-13(5-2)11-17-14(18)10-12(3)22-16(21)9-8-15(19)20/h12-13H,4-11H2,1-3H3,(H,17,18)(H,19,20)
InChIKey CQONVBIGUJWUFE-UHFFFAOYSA-N
SMILES CCCCC(CC)CNC(=O)CC(C)OC(=O)CCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Butoctamide hydrogen succinate (CHEBI:31326) is a dicarboxylic acid monoester (CHEBI:36244)
Butoctamide hydrogen succinate (CHEBI:31326) is a hemisuccinate (CHEBI:138979)
Butoctamide hydrogen succinate (CHEBI:31326) is a secondary carboxamide (CHEBI:140325)
Synonyms Sources
Butoctamide hydrogen succinate KEGG COMPOUND
Butoctamide semisuccinate KEGG COMPOUND
Manual Xrefs Databases
C12946 KEGG COMPOUND
D01498 KEGG DRUG
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Registry Number Type Source
32838-28-1 CAS Registry Number KEGG COMPOUND
Last Modified
07 March 2018