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Hexacosanoyl Carnitine

PropertiesImage
MNX_IDMNXM8714 Image of MNXM8714
referencechebi:139536
formulaC33H65NO4
global charge0
mol weight539.886
InChIKeyKOCKWDDTAHPJSX-UHFFFAOYSA-N
InChIInChI=1S/C33H65NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-33(37)38-31(29-32(35)36)30-34(2,3)4/h31H,5-30H2,1-4H3
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C33H65NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-33(37)38-31(29-32(35)36)30-34(2,3)4/h31H,5-30H2,1-4H3/t31? Image of MNXM8714
SMILES (mnx)[CH3:1][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][C:33](=[O:37])[O:38][CH:31]([CH2:29][C:32](=[O:35])[O-:36])[CH2:30][N+:34]([CH3:2])([CH3:3])[CH3:4]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:139536
chebi:139536
KOCKWDDTAHPJSX-UHFFFAOYSA-N
Hexacosanoyl Carnitine
3-(hexacosanoyloxy)-4-(trimethylazaniumyl)butanoate

bigg.metabolite:hexccrn
biggM:hexccrn
KOCKWDDTAHPJSX-UHFFFAOYSA-N
Hexacosanoyl carnitine

lipidmaps:LMFA07070069
lipidmapsM:LMFA07070069
KOCKWDDTAHPJSX-UHFFFAOYSA-N
Hexacosanoyl carnitine
3-(hexacosanoyloxy)-4-(trimethylazaniumyl)butanoate
CAR 26:0
hmdb:HMDB0006347
KOCKWDDTAHPJSX-UHFFFAOYSA-N
Hexacosanoyl carnitine
3-(hexacosanoyloxy)-4-(trimethylazaniumyl)butanoate
hexacosanoyl carnitine

vmhM:hexccrn
vmhmetabolite:hexccrn
KOCKWDDTAHPJSX-UHFFFAOYSA-N
hexacosanoyl carnitine
3-(hexacosanoyloxy)-4-(trimethylazaniumyl)butanoate

hmdb:HMDB06347
biggM:M_hexccrn
vmhM:M_hexccrn
secondary/obsolete/fantasy identifier