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H-γ-Glu-Abu-Oh

CAT: 0572-TRC-G245138-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-G245138-250MGSize:250 mg
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CAS Number
16869-42-4
Synonyms
H-gamma-Glu-Abu-Oh
Hazard Statement
No Data Available
Smiles
CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O
Molecular Formula
C9 H16 N2 O5
Molecular Weight
232.234
InChI
InChI=1S/C9H16N2O5/c1-2-6(9(15)16)11-7(12)4-3-5(10)8(13)14/h5-6H,2-4,10H2,1H3,(H,11,12)(H,13,14)(H,15,16)/t5-,6-/m0/s1
Additionnal Information
IUPAC name: (2S)-2-amino-5-[[(1S)-1-carboxypropyl]amino]-5-oxopentanoic acid

Chemical Information

gamma-Glutamyl-alpha-aminobutyrate

Gamma-L-Glutamyl-L-2-aminobutyrate is a dipeptide. It is a conjugate acid of a gamma-L-glutamyl-(2S)-2-aminobutanoate.

CAS Number16869-42-4
PubChem CID7014903
IUPAC Name(2S)-2-amino-5-[[(1S)-1-carboxypropyl]amino]-5-oxopentanoic acid
Molecular FormulaC9H16N2O5
Molecular Weight232.23
XLogP-3.2
Topological Polar Surface Area130
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count16
Formal Charge0
Complexity279
SMILES
CC[C@@H](C(=O)O)NC(=O)CC[C@@H](C(=O)O)N
InChI
InChI=1S/C9H16N2O5/c1-2-6(9(15)16)11-7(12)4-3-5(10)8(13)14/h5-6H,2-4,10H2,1H3,(H,11,12)(H,13,14)(H,15,16)/t5-,6-/m0/s1
InChIKey
FUZOZPRKGAXGOB-WDSKDSINSA-N
Chemical Structure
2D Structure
2D structure of gamma-Glutamyl-alpha-aminobutyrate
CAS: 16869-42-4
CID: 7014903
Formula: C9H16N2O5
MW: 232.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight232.23
XLogP3-3.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass232.10592162
Monoisotopic Mass232.10592162
Topological Polar Surface Area130 Ų
Heavy Atom Count16
Formal Charge0
Complexity279
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