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Decanoyl-L-carnitine

CAT: 0931-T200420-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T200420-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3992-45-8
Target
Others
Related Pathways
Others
Purity
0.9965
Bioactivity
Decanoyl-L-carnitine ((-) -Decanoylcarnitine) is a L-carnitine derivative that promotes the formation of saturated fatty acid metabolites.
Smiles
[C@H](OC(CCCCCCCCC)=O)(C[N+](C)(C)C)CC([O-])=O
Molecular Formula
C17H33NO4
Molecular Weight
315.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

O-Decanoyl-L-carnitine

O-decanoyl-L-carnitine is an O-acyl-L-carnitine that is L-carnitine having decanoyl as the acyl substituent. 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-decanoylcarnitine.

CAS Number3992-45-8
PubChem CID11953821
IUPAC Name(3R)-3-decanoyloxy-4-(trimethylazaniumyl)butanoate
Molecular FormulaC17H33NO4
Molecular Weight315.4
XLogP4.5
Topological Polar Surface Area66.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Heavy Atom Count22
Formal Charge0
Complexity318
SMILES
CCCCCCCCCC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C
InChI
InChI=1S/C17H33NO4/c1-5-6-7-8-9-10-11-12-17(21)22-15(13-16(19)20)14-18(2,3)4/h15H,5-14H2,1-4H3/t15-/m1/s1
InChIKey
LZOSYCMHQXPBFU-OAHLLOKOSA-N
Chemical Structure
2D Structure
2D structure of O-Decanoyl-L-carnitine
CAS: 3992-45-8
CID: 11953821
Formula: C17H33NO4
MW: 315.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.4
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Exact Mass315.24095853
Monoisotopic Mass315.24095853
Topological Polar Surface Area66.4 Ų
Heavy Atom Count22
Formal Charge0
Complexity318
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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