CHEBI:173761 - Neoherculin

ChEBI IDCHEBI:173761
ChEBI NameNeoherculin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H25NO
Net Charge0
Average Mass247.382
Monoisotopic Mass247.19361
SMILESC/C=C\C=C\C=C/CC/C=C/C(=O)NCC(C)C
InChIInChI=1S/C16H25NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h4-9,12-13,15H,10-11,14H2,1-3H3,(H,17,18)/b5-4-,7-6+,9-8-,13-12+
InChIKeySBXYHCVXUCYYJT-JRNWQWJGSA-N
ChEBI Ontology
Outgoing Relation(s)
Neoherculin (CHEBI:173761) is a carboximidic acid (CHEBI:48378)
IUPAC Name 
(2E,6Z,8E,10Z)-N-(2-methylpropyl)dodeca-2,6,8,10-tetraenamide
Manual XrefsDatabases
C17091KEGG COMPOUND
30776873ChemSpider
HMDB0030955HMDB