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H-Val-Ala-OH

CAT: 0121-4007094.0005Size: 5 gDry Ice: NoHazardous: No
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CAT#:0121-4007094.0005Size:5 g
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CAS Number
27493-61-4
Specifications
G-3500.0005
Sequence
H-Val-Ala-OH
Molecular Formula
C₈H₁₆N₂O₃
Molecular Weight
188.23
Shipping Conditions
Ambient Temperature
Storage Temperature
< -15°C

Chemical Information

Val-Ala

Val-Ala is a dipeptide formed from L-valine and L-alanine residues. It has a role as a metabolite.

CAS Number27493-61-4
PubChem CID6992638
IUPAC Name(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]propanoic acid
Molecular FormulaC8H16N2O3
Molecular Weight188.22
XLogP-3.8
Topological Polar Surface Area92.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity204
SMILES
C[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)N
InChI
InChI=1S/C8H16N2O3/c1-4(2)6(9)7(11)10-5(3)8(12)13/h4-6H,9H2,1-3H3,(H,10,11)(H,12,13)/t5-,6-/m0/s1
InChIKey
HSRXSKHRSXRCFC-WDSKDSINSA-N
Chemical Structure
2D Structure
2D structure of Val-Ala
CAS: 27493-61-4
CID: 6992638
Formula: C8H16N2O3
MW: 188.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight188.22
XLogP3-3.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass188.11609238
Monoisotopic Mass188.11609238
Topological Polar Surface Area92.4 Ų
Heavy Atom Count13
Formal Charge0
Complexity204
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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