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(Q105279325)
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English
(6E)-7-(2H-1,3-Benzodioxol-5-YL)-1-(pyrrolidin-1-YL)hept-6-EN-1-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkaloid
0 references
mass
301.167793596
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₃NO₃
0 references
canonical SMILES
O=C(N1CCCC1)CCCCC=CC2=CC=C3OCOC3=C2
0 references
isomeric SMILES
O=C(CCCC/C=C/c1ccc2c(c1)OCO2)N1CCCC1
1 reference
based on heuristic
inferred from InChI
found in taxon
Piper nigrum
3 references
stated in
Synthesis and nematocidal activity of aralkyl- and aralkenylamides related to piperamide on second-stage larvae of Toxocara canis
stated in
Alkamides from Piper nigrum L. and Their Inhibitory Activity against Human Liver Microsomal Cytochrome P450 2D6 (CYP2D6)
stated in
Structural elucidation and synthesis of new components isolated from(piperaceae)
Identifiers
InChI
InChI=1S/C18H23NO3/c20-18(19-11-5-6-12-19)8-4-2-1-3-7-15-9-10-16-17(13-15)22-14-21-16/h3,7,9-10,13H,1-2,4-6,8,11-12,14H2/b7-3+
0 references
InChIKey
UUHCCOYKUNWUQJ-XVNBXDOJSA-N
0 references
CAS Registry Number
117137-66-3
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
10957591
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
2050634
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID501016732
1 reference
matched by identifier from
InChIKey
InChIKey
UUHCCOYKUNWUQJ-XVNBXDOJSA-N
Human Metabolome Database ID
HMDB0302870
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UUHCCOYKUNWUQJ-XVNBXDOJSA-N
KNApSAcK ID
C00054868
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UUHCCOYKUNWUQJ-XVNBXDOJSA-N
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