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DL-Stearoylcarnitine

CAT: 0804-HY-113202ASize: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-113202ASize:1 Each
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Description
DL-Stearoylcarnitine is the racemate of Stearoylcarnitine.
CAS Number
1976-27-8
UNSPSC
12352211
Target
Endogenous Metabolite
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/dl-stearoylcarnitine.html
Smiles
CCCCCCCCCCCCCCCCCC(OC(C[N+](C)(C)C)CC([O-])=O)=O
Molecular Formula
C25H49NO4
Molecular Weight
427.66
References & Citations
[1]Joseph J, et al., Metabolomic Analyses Reveal Extensive Progenitor Cell Deficiencies in a Mouse Model of Duchenne Muscular Dystrophy. Metabolites. 2018 Oct 3;8 (4) :61.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Stearoylcarnitine

O-stearoylcarnitine is an O-acylcarnitine having stearoyl (octadecanoyl) as the acyl substituent. It has a role as a human metabolite. It is functionally related to an octadecanoic acid.

CAS Number1976-27-8
PubChem CID6426855
IUPAC Name3-octadecanoyloxy-4-(trimethylazaniumyl)butanoate
Molecular FormulaC25H49NO4
Molecular Weight427.7
XLogP8.8
Topological Polar Surface Area66.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count21
Heavy Atom Count30
Formal Charge0
Complexity426
SMILES
CCCCCCCCCCCCCCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C
InChI
InChI=1S/C25H49NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h23H,5-22H2,1-4H3
InChIKey
FNPHNLNTJNMAEE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Stearoylcarnitine
CAS: 1976-27-8
CID: 6426855
Formula: C25H49NO4
MW: 427.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight427.7
XLogP38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count21
Exact Mass427.36615904
Monoisotopic Mass427.36615904
Topological Polar Surface Area66.4 Ų
Heavy Atom Count30
Formal Charge0
Complexity426
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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A18721-50Stearoylcarnitine 50mg
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