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O-octanedioylcarnitine

PropertiesImage
MNX_IDMNXM729942 Image of MNXM729942
referencechebi:77083
formulaC15H26NO6
global charge-1
mol weight316.374
InChIKeyYVWVEIPYMGBQPE-UHFFFAOYSA-M
InChIInChI=1S/C15H27NO6/c1-16(2,3)11-12(10-14(19)20)22-15(21)9-7-5-4-6-8-13(17)18/h12H,4-11H2,1-3H3,(H-,17,18,19,20)/p-1
SMILESC[N+](C)(C)CC(CC(=O)[O-])OC(=O)CCCCCCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C15H27NO6/c1-16(2,3)11-12(10-14(19)20)22-15(21)9-7-5-4-6-8-13(17)18/h12H,4-11H2,1-3H3,(H-,17,18,19,20)/t12? Image of MNXM729942
SMILES (mnx)[CH3:1][N+:16]([CH3:2])([CH3:3])[CH2:11][CH:12]([CH2:10][C:14](=[O:19])[O-:20])[O:22][C:15]([CH2:9][CH2:7][CH2:5][CH2:4][CH2:6][CH2:8][C:13](=[O:17])[OH:18])=[O:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 5
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:77083
chebi:77083
YVWVEIPYMGBQPE-UHFFFAOYSA-M 		O-octanedioylcarnitine
8-{[1-carboxylato-3-(trimethylazaniumyl)propan-2-yl]oxy}-8-oxooctanoate
O-DC8:0carnitine(1-)
O-octanedioylcarnitine(1-)
O-suberoylcarnitine(1-)

SLM:000000871
slm:000000871
YVWVEIPYMGBQPE-UHFFFAOYSA-M 		O-octanedioylcarnitine
hmdb:HMDB0241733
YVWVEIPYMGBQPE-UHFFFAOYSA-N 		Octanedioylcarnitine
3-[(7-carboxyheptanoyl)oxy]-4-(trimethylammonio)butanoate
3-[(7-carboxyheptanoyl)oxy]-4-(trimethylazaniumyl)butanoate

bigg.metabolite:c8dc
biggM:c8dc
YVWVEIPYMGBQPE-UHFFFAOYSA-M 		Suberyl carnitine
octanedioyl carnitine

vmhM:c8dc
vmhmetabolite:c8dc
YVWVEIPYMGBQPE-UHFFFAOYSA-M 		suberyl carnitine

biggM:M_c8dc
vmhM:M_c8dc 		secondary/obsolete/fantasy identifier