input word = C00052313

Metabolite InformationStructural formula
Name Hexanoyl-L-carnitine
Formula C13H25NO4
Mw 259.17835829
CAS RN 22671-29-0
C_ID C00052313
InChIKey VVPRQWTYSNDTEA-LLVKDONJSA-N
InChICode InChI=1S/C13H25NO4/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4/h11H,5-10H2,1-4H3/t11-/m1/s1
SMILES CCCCCC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
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OrganismHomo sapiens (Urine)
ReferencePLoS ONE., 2013, 8(9), e73076