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(2S,4S) -gamma-Hydroxyglutamic acid

CAT: 0024-sc-288615ASize: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-288615ASize:1 g
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CAS Number
3913-68-6

Chemical Information

(4S)-4-Hydroxy-L-glutamic acid
CAS Number3913-68-6
PubChem CID192790
IUPAC Name(2S,4S)-2-amino-4-hydroxypentanedioic acid
Molecular FormulaC5H9NO5
Molecular Weight163.13
XLogP-4.1
Topological Polar Surface Area121
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count11
Formal Charge0
Complexity168
SMILES
C([C@@H](C(=O)O)N)[C@@H](C(=O)O)O
InChI
InChI=1S/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/t2-,3-/m0/s1
InChIKey
HBDWQSHEVMSFGY-HRFVKAFMSA-N
Chemical Structure
2D Structure
2D structure of (4S)-4-Hydroxy-L-glutamic acid
CAS: 3913-68-6
CID: 192790
Formula: C5H9NO5
MW: 163.13
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight163.13
XLogP3-4.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass163.04807239
Monoisotopic Mass163.04807239
Topological Polar Surface Area121 Ų
Heavy Atom Count11
Formal Charge0
Complexity168
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