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L-Hexanoylcarnitine 10mg

CAT: 0628-A18754-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A18754-10Size:10 mg
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CAS Number
22671-29-0

Chemical Information

L-Hexanoylcarnitine

O-hexanoyl-L-carnitine is an O-hexanoylcarnitine that has L configuration. It has a role as a human metabolite. It is a saturated fatty acyl-L-carnitine, a medium-chain fatty acyl-L-carnitine and an O-hexanoylcarnitine.

CAS Number22671-29-0
PubChem CID3246938
IUPAC Name(3R)-3-hexanoyloxy-4-(trimethylazaniumyl)butanoate
Molecular FormulaC13H25NO4
Molecular Weight259.34
XLogP2.3
Topological Polar Surface Area66.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Heavy Atom Count18
Formal Charge0
Complexity265
SMILES
CCCCCC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C
InChI
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
InChIKey
VVPRQWTYSNDTEA-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of L-Hexanoylcarnitine
CAS: 22671-29-0
CID: 3246938
Formula: C13H25NO4
MW: 259.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight259.34
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass259.17835828
Monoisotopic Mass259.17835828
Topological Polar Surface Area66.4 Ų
Heavy Atom Count18
Formal Charge0
Complexity265
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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