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Dehydropipernonaline

Properties

Image

Occurences in reactions

MNX_ID

MNXM124266

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₁H₂₅NO₃

charge

mass

339.18344

reference

chebi:174566

InChIKey

KAYVDASZRFLFRZ-PQECNABGSA-N

InChI

InChI=1S/C21H25NO3/c23-21(22-14-8-5-9-15-22)11-7-4-2-1-3-6-10-18-12-13-19-20(16-18)25-17-24-19/h2,4,6-7,10-13,16H,1,3,5,8-9,14-15,17H2/b4-2+,10-6+,11-7+

SMILES

O=C(/C=C/C=C/CC/C=C/c1ccc2c(c1)OCO2)N1CCCCC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:174566 chebi:174566	Dehydropipernonaline (2E,4E,8E)-9-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylnona-2,4,8-trien-1-one
hmdb:HMDB0040811	Dehydropipernonaline (2E,4E,8E)-9-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)nona-2,4,8-trien-1-one 9-(3,4-Methylenedioxy)-2,4,8-nonatrienoic acid piperidide N-(9-(3,4-Methylenedioxyphenyl)-2,4,8-nonatrienoyl)piperidine
hmdb:HMDB40811	secondary/obsolete/fantasy identifier