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Stearidonyl carnitine

PropertiesImage
MNX_IDMNXM1372546 Image of MNXM1372546
referencechebi:175355
formulaC25H41NO4
global charge0
mol weight419.606
InChIKeyUQCYGYDOQKYSDD-IIWKRHCOSA-N
InChIInChI=1S/C25H41NO4/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/h6-7,9-10,13-14,17-18,23H,5,8,11-12,15-16,19-22H2,1-4H3/b7-6-,10-9-,14-13-,18-17-
SMILESCC/C=C\C/C=C\CC/C=C\CC/C=C\CCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C25H41NO4/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/h6-7,9-10,13-14,17-18,23H,5,8,11-12,15-16,19-22H2,1-4H3/b7-6-,10-9-,14-13-,18-17-/t23? Image of MNXM1372546
SMILES (mnx)[CH3:1][CH2:5]/[CH:6]=[CH:7]\[CH2:8]/[CH:9]=[CH:10]\[CH2:11][CH2:12]/[CH:13]=[CH:14]\[CH2:15][CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:20][C:25](=[O:29])[O:30][CH:23]([CH2:21][C:24](=[O:27])[O-:28])[CH2:22][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:175355
chebi:175355
UQCYGYDOQKYSDD-IIWKRHCOSA-N
Stearidonyl carnitine
3-[(4Z,8Z,12Z,15Z)-octadeca-4,8,12,15-tetraenoyl]oxy-4-(trimethylazaniumyl)butanoate

bigg.metabolite:strdnccrn
biggM:strdnccrn
UQCYGYDOQKYSDD-IIWKRHCOSA-N
Stearidonyl carnitine
hmdb:HMDB0006463
UQCYGYDOQKYSDD-IIWKRHCOSA-N
Stearidonyl carnitine
3-[(4Z,8Z,12Z,15Z)-octadeca-4,8,12,15-tetraenoyloxy]-4-(trimethylazaniumyl)butanoate
stearidonyl carnitine

vmhM:strdnccrn
vmhmetabolite:strdnccrn
UQCYGYDOQKYSDD-IIWKRHCOSA-N
stearidonyl carnitine

hmdb:HMDB06463
biggM:M_strdnccrn
vmhM:M_strdnccrn
secondary/obsolete/fantasy identifier