Search MNXref
 Feedback

Pelletierine

PropertiesImage
MNX_IDMNXM5256 Image of MNXM5256
referencechebi:7952
formulaC8H15NO
global charge0
mol weight141.214
InChIKeyJEIZLWNUBXHADF-UHFFFAOYSA-N
InChIInChI=1S/C8H15NO/c1-7(10)6-8-4-2-3-5-9-8/h8-9H,2-6H2,1H3
SMILESCC(=O)CC1CCCCN1
MNX internals
InChI (mnx)InChI=1/C8H15NO/c1-7(10)6-8-4-2-3-5-9-8/h8-9H,2-6H2,1H3/t8? Image of MNXM5256
SMILES (mnx)[CH3:1][C:7]([CH2:6][CH:8]1[CH2:4][CH2:2][CH2:3][CH2:5][NH:9]1)=[O:10]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd03692
seedM:cpd03692
CHEBI:7952
chebi:7952
kegg.compound:C06182
keggC:C06182
JEIZLWNUBXHADF-UHFFFAOYSA-N
JEIZLWNUBXHADF-UHFFFAOYSA-O 		Pelletierine
hmdb:HMDB0030325
JEIZLWNUBXHADF-UHFFFAOYSA-N 		(+/-)-Pelletierine
(+-)-1-(2-Piperidinyl)-2-propanone
(+-)-Isomer OF isopelletierine
(+-)-Pelletierine
(-)-Isomer OF isopelletierine
1-(piperidin-2-yl)propan-2-one
2-Acetonylpiperidine
2-Propanone, 1-(2-piperidinyl)-, (+-) (9ci)
DL-Pelletierine
Isopelletierine
pelletierine

hmdb:HMDB30325
keggC:M_C06182
seedM:M_cpd03692 		secondary/obsolete/fantasy identifier