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Isovalerylcarnitine 5mg

CAT: 0628-A18690-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A18690-5Size:5 mg
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CAS Number
31023-24-2

Chemical Information

Isovalerylcarnitine

Isovaleryl-L-carnitine is an O-isovalerylcarnitine that is the 3-methylbutanoyl (isovaleryl) derivative of L-carnitine. It has a role as a bone density conservation agent. It is a methyl-branched fatty acyl-L-carnitine and an O-isovalerylcarnitine.

CAS Number31023-24-2
PubChem CID169235
IUPAC Name(3R)-3-(3-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate
Molecular FormulaC12H23NO4
Molecular Weight245.32
XLogP1.6
Topological Polar Surface Area66.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count17
Formal Charge0
Complexity263
SMILES
CC(C)CC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C
InChI
InChI=1S/C12H23NO4/c1-9(2)6-12(16)17-10(7-11(14)15)8-13(3,4)5/h9-10H,6-8H2,1-5H3/t10-/m1/s1
InChIKey
IGQBPDJNUXPEMT-SNVBAGLBSA-N
Chemical Structure
2D Structure
2D structure of Isovalerylcarnitine
CAS: 31023-24-2
CID: 169235
Formula: C12H23NO4
MW: 245.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight245.32
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass245.16270821
Monoisotopic Mass245.16270821
Topological Polar Surface Area66.4 Ų
Heavy Atom Count17
Formal Charge0
Complexity263
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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Alternative Products

CatalogName
MBS3843150-01Isovalerylcarnitine
HY-113221RIsovalerylcarnitine (Standard)
HY-145542-01Isovalerylcarnitine (chloride)
TRC-I238061-10MGIsovalerylcarnitine-d9
HY-145542R-01Isovalerylcarnitine (chloride) (Standard)
HY-145542SIsovalerylcarnitine-d9 (chloride)
HY-113221AS-01Isovalerylcarnitine-d3 (chloride)
HY-W654243Isovalerylcarnitine-d9-1 (chloride)
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