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(9E)-octadec-9-enoylcarnitine

Properties

Image

Occurences in reactions

MNX_ID

MNXM8576

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	16

formula

C₂₅H₄₇NO₄

charge

mass

425.35051

reference

InChIKey

IPOLTUVFXFHAHI-OUKQBFOZSA-N

InChI

InChI=1S/C25H47NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h12-13,23H,5-11,14-22H2,1-4H3/b13-12+

SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:86038 chebi:86038	(9E)-octadec-9-enoylcarnitine 3-{[(9E)-octadec-9-enoyl]oxy}-4-(trimethylazaniumyl)butanoate elaidic carnitine
bigg.metabolite:elaidcrn biggM:elaidcrn	Elaidic carnitine
lipidmaps:LMFA07070063 lipidmapsM:LMFA07070063	Elaidic carnitine 3-[(9E)-octadec-9-enoyloxy]-4-(trimethylazaniumyl)butanoate CAR 18:1
hmdb:HMDB0006464	Elaidic carnitine 3-[(9E)-octadec-9-enoyloxy]-4-(trimethylazaniumyl)butanoate elaidic carnitine
hmdb:HMDB06464 biggM:M_elaidcrn	secondary/obsolete/fantasy identifier