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CHEBI:80781 - Pahutoxin

Default Structure
ChEBI IDCHEBI:80781
ChEBI NamePahutoxin
Stars
DownloadsMolfile
FormulaC23H46NO4.Cl
Net Charge0
Average Mass436.077
Monoisotopic Mass435.31154
SMILESCCCCCCCCCCCCC[C@@H](CC(=O)OCC[N+](C)(C)C)OC(C)=O.[Cl-]
InChIInChI=1S/C23H46NO4.ClH/c1-6-7-8-9-10-11-12-13-14-15-16-17-22(28-21(2)25)20-23(26)27-19-18-24(3,4)5;/h22H,6-20H2,1-5H3;1H/q+1;/p-1/t22-;/m0./s1
InChIKeyNJEOXMPQOCEVAI-FTBISJDPSA-M
ChEBI Ontology
Outgoing Relation(s)
Pahutoxin (CHEBI:80781) is a organic molecular entity (CHEBI:50860)
Manual XrefsDatabases
C16889KEGG COMPOUND
Registry NumbersSources
CAS:27742-14-9KEGG COMPOUND