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CHEBI:191466 - Dipiperamide C

ChEBI IDCHEBI:191466
ChEBI NameDipiperamide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H36N2O6
Net Charge0
Average Mass556.659
Monoisotopic Mass556.25734
SMILESO=C([C@@H]1[C@H](/C=C/c2ccc3c(c2)OCO3)[C@@H](/C=C/c2ccc3c(c2)OCO3)[C@H]1C(=O)N1CCCC1)N1CCCCC1
InChIInChI=1S/C33H36N2O6/c36-32(34-14-2-1-3-15-34)30-24(10-6-22-8-12-26-28(18-22)40-20-38-26)25(31(30)33(37)35-16-4-5-17-35)11-7-23-9-13-27-29(19-23)41-21-39-27/h6-13,18-19,24-25,30-31H,1-5,14-17,20-21H2/b10-6+,11-7+/t24-,25-,30-,31-/m1/s1
InChIKeyMCEKBNRLKGLRNJ-HKXXWITFSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
ChEBI Ontology
Outgoing Relation(s)
Dipiperamide C (CHEBI:191466) is a benzodioxoles (CHEBI:38298)
Dipiperamide C (CHEBI:191466) is a cyclobutanes (CHEBI:156473)
IUPAC Name 
[(1R,2R,3R,4R)-2,3-bis[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-(pyrrolidine-1-carbonyl)cyclobutyl]-piperidin-1-ylmethanone
Manual XrefsDatabases
8206184ChemSpider