CHEBI:81837 - Iminoctadine acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Iminoctadine acetate
ChEBI ID CHEBI:81837
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H53N7O6
Net Charge 0
Average Mass 535.72090
Monoisotopic Mass 535.40573
InChI InChI=1S/C18H41N7.3C2H4O2/c19-17(20)24-15-11-7-3-1-5-9-13-23-14-10-6-2-4-8-12-16-25-18(21)22;3*1-2(3)4/h23H,1-16H2,(H4,19,20,24)(H4,21,22,25);3*1H3,(H,3,4)
InChIKey FKWDSATZSMJRLC-UHFFFAOYSA-N
SMILES N(CCCCCCCCNC(=N)N)CCCCCCCCNC(N)=N.CC(O)=O.CC(O)=O.CC(O)=O
ChEBI Ontology
Outgoing Iminoctadine acetate (CHEBI:81837) is a polymer (CHEBI:60027)
Manual Xref Database
C18568 KEGG COMPOUND
View more database links
Registry Number Type Source
57520-17-9 CAS Registry Number KEGG COMPOUND