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Alpha-linolenyl carnitine

Properties

Image

Occurences in reactions

MNX_ID

MNXM8289

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	5

formula

C₂₅H₄₃NO₄

charge

mass

421.31921

reference

biggM:lnlncacrn

InChIKey

DFVGGGHKDAHYIU-UHMZJXMFSA-N

InChI

InChI=1S/C25H43NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(26(2,3)4)21-22-24(27)28/h6-7,9-10,12-13,23H,5,8,11,14-22H2,1-4H3/b7-6-,10-9-,13-12-/t23-/m0/s1

SMILES

CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@@H](CCC(=O)[O-])[N+](C)(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
bigg.metabolite:lnlncacrn biggM:lnlncacrn	Alpha-linolenyl carnitine
hmdb:HMDB0006319	Alpha-linolenyl carnitine (3S)-3-[(9Z,12Z,15Z)-Octadeca-9,12,15-trienoyloxy]-4-(trimethylazaniumyl)butanoic acid (3S)-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]-4-(trimethylammonio)butanoate (3S)-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]-4-(trimethylazaniumyl)butanoate a-Linolenyl carnitine alpha-linolenyl carnitine
hmdb:HMDB06319 biggM:M_lnlncacrn	secondary/obsolete/fantasy identifier