Search MNXref
 Feedback

gamma-Linolenyl carnitine

MNXM8635 is deprecated and here replaced by MNXM1372333
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1372333 Image of MNXM1372333
referencechebi:165634
formulaC25H43NO4
global charge0
mol weight421.622
InChIKeyVDPMHVILMVSAQX-BAHSRKMSSA-N
InChIInChI=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/h9-10,12-13,15-16,23H,5-8,11,14,17-22H2,1-4H3/b10-9-,13-12-,16-15-/t23-/m0/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](CCC(=O)[O-])[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/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/h9-10,12-13,15-16,23H,5-8,11,14,17-22H2,1-4H3/b10-9-,13-12-,16-15-/t23-/m0/s1 Image of MNXM1372333
SMILES (mnx)[CH3:1][CH2:5][CH2:6][CH2:7][CH2:8]/[CH:9]=[CH:10]\[CH2:11]/[CH:12]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17][CH2:18][CH2:19][CH2:20][C:25](=[O:29])[O:30][C@@H:23]([CH2:21][CH2:22][C:24](=[O:27])[O-:28])[N+:26]([CH3:2])([CH3:3])[CH3:4]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:165634
chebi:165634
VDPMHVILMVSAQX-BAHSRKMSSA-N 		gamma-Linolenyl carnitine
(4S)-4-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyl]oxy-4-(trimethylazaniumyl)butanoate

bigg.metabolite:lnlncgcrn
biggM:lnlncgcrn
VDPMHVILMVSAQX-BAHSRKMSSA-N 		Gamma-linolenyl carnitine

vmhM:lnlncgcrn
vmhmetabolite:lnlncgcrn
VDPMHVILMVSAQX-BAHSRKMSSA-N 		gamma-linolenyl carnitine
(3S)-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]-4-(trimethylazaniumyl)butanoate

biggM:M_lnlncgcrn
vmhM:M_lnlncgcrn 		secondary/obsolete/fantasy identifier