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CHEBI:189335 - 6,6'-(1,2,3,5,8,8a-Hexahydroindolizine-6,8-diyldi-10,1-decanediyl)bis(2-methyl-3-piperidinol)

ChEBI IDCHEBI:189335
ChEBI Name6,6'-(1,2,3,5,8,8a-Hexahydroindolizine-6,8-diyldi-10,1-decanediyl)bis(2-methyl-3-piperidinol)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H75N3O2
Net Charge0
Average Mass630.059
Monoisotopic Mass629.58593
SMILESCC1NC(CCCCCCCCCCC2=CC(CCCCCCCCCCC3CCC(O)C(C)N3)C3CCCN3C2)CCC1O
InChIInChI=1S/C40H75N3O2/c1-32-39(44)27-25-36(41-32)22-17-13-9-5-3-7-11-15-20-34-30-35(38-24-19-29-43(38)31-34)21-16-12-8-4-6-10-14-18-23-37-26-28-40(45)33(2)42-37/h30,32-33,35-42,44-45H,3-29,31H2,1-2H3
InChIKeyJOTBJXJGDRSICD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
6,6'-(1,2,3,5,8,8a-Hexahydroindolizine-6,8-diyldi-10,1-decanediyl)bis(2-methyl-3-piperidinol) (CHEBI:189335) is a citraconoyl group (CHEBI:23315)
IUPAC Name 
6-[10-[6-[10-(5-hydroxy-6-methylpiperidin-2-yl)decyl]-1,2,3,5,8,8a-hexahydroindolizin-8-yl]decyl]-2-methylpiperidin-3-ol
Manual XrefsDatabases
113776ChemSpider
Registry NumbersSources
CAS:66771-80-0ChemIDplus