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hydroxyisovaleroyl carnitine

PropertiesImage
MNX_IDMNXM156642 Image of MNXM156642
referencechebi:168980
formulaC12H23NO5
global charge0
mol weight261.318
InChIKeyDHRNMNHPSWBJEN-UHFFFAOYSA-N
InChIInChI=1S/C12H23NO5/c1-9(2)6-11(16)18-12(17,7-10(14)15)8-13(3,4)5/h9,17H,6-8H2,1-5H3
SMILESCC(C)CC(=O)OC(O)(CC(=O)[O-])C[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C12H23NO5/c1-9(2)6-11(16)18-12(17,7-10(14)15)8-13(3,4)5/h9,17H,6-8H2,1-5H3/t12? Image of MNXM156642
SMILES (mnx)[CH3:1][CH:9]([CH3:2])[CH2:6][C:11](=[O:16])[O:18][C:12]([CH2:7][C:10](=[O:14])[O-:15])([CH2:8][N+:13]([CH3:3])([CH3:4])[CH3:5])[OH:17]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:168980
chebi:168980
DHRNMNHPSWBJEN-UHFFFAOYSA-N 		hydroxyisovaleroyl carnitine
3-hydroxy-3-(3-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate
hmdb:HMDB0062555
DHRNMNHPSWBJEN-UHFFFAOYSA-N 		hydroxyisovaleroyl carnitine
3-hydroxy-3-[(3-methylbutanoyl)oxy]-4-(trimethylammonio)butanoate
3-hydroxy-3-[(3-methylbutanoyl)oxy]-4-(trimethylazaniumyl)butanoate

lipidmaps:LMFA07070073
lipidmapsM:LMFA07070073
DHRNMNHPSWBJEN-UHFFFAOYSA-N 		hydroxyisovaleroyl carnitine
3-hydroxy-3-isovaleryloxy-4-(trimethylammonio)butyrate
CAR 5:0
O

hmdb:HMDB62555 		secondary/obsolete/fantasy identifier