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L-Alloisoleucine

CAT: 0013-GTR19169446-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19169446-01Size:50 mg
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Description
L-Alloisoleucine is a stereoisomer of L-isoleucine and a key diagnostic marker for Maple Syrup Urine Disease (MSUD), with plasma levels above 5 μmol/L being pathognomonic. This research chemical is used in metabolic disorder studies, including in vitro enzyme assays and in vivo models of branched-chain amino acid metabolism.
CAS Number
1509-34-8
Product Name Alternative
(3R) -LS-Isoleucine, LS-Isoleucine, inhibit, L Alloisoleucine, L (+) -Alloisoleucine, EndogenousMetabolite, Endogenous Metabolite, LAlloisoleucine, L-Alloisoleucine, L-allo-Isoleucine, Inhibitor
Field of Research
Metabolism Research
Purity
≥95% (May vary between batches)
Solubility
DMSO:Slightly soluble
Smiles
CC[C@@H] (C) [C@H] (N) C (O) =O
Molecular Formula
C6H13NO2
Molecular Weight
131.17
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Alloisoleucine, DL-

L-alloisoleucine is an optically active form of alloisoleucine having L-(2S,3R)-configuration. It has a role as a human metabolite. It is an alloisoleucine and a non-proteinogenic L-alpha-amino acid. It is an enantiomer of a D-alloisoleucine. It is a tautomer of a L-alloisoleucine zwitterion.

CAS Number1509-34-8
PubChem CID99288
IUPAC Name(2S,3R)-2-amino-3-methylpentanoic acid
Molecular FormulaC6H13NO2
Molecular Weight131.17
XLogP-1.7
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count9
Formal Charge0
Complexity103
SMILES
CC[C@@H](C)[C@@H](C(=O)O)N
InChI
InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m1/s1
InChIKey
AGPKZVBTJJNPAG-UHNVWZDZSA-N
Chemical Structure
2D Structure
2D structure of Alloisoleucine, DL-
CAS: 1509-34-8
CID: 99288
Formula: C6H13NO2
MW: 131.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight131.17
XLogP3-1.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass131.094628657
Monoisotopic Mass131.094628657
Topological Polar Surface Area63.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity103
Isotope Atom Count0
Defined Atom Stereocenter Count2
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
HY-I1060-01L-Alloisoleucine
HY-I1060R-01L-Alloisoleucine (Standard)
HY-I1060SL-Alloisoleucine-d10
HY-I1061-01((Benzyloxy) carbonyl) -L-alloisoleucine
M36411-01Fmoc-N-methyl-L-alloisoleucine
HY-78912-01D-Alloisoleucine
OR929224-01Acetyl-d-alloisoleucine
BA9477-25000Benzyloxycarbonyl-D-alloisoleucine
A23105-100000D-Alloisoleucine 100g
A23105-25000D-Alloisoleucine 25g

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