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Glutamic acid diethyl ester

CAT: 0931-T2A2497L-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T2A2497L-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
16450-41-2
Target
Others, Endogenous Metabolite
Related Pathways
Metabolism, Others
Bioactivity
Glutamic acid diethyl ester is a glutamic acid antagonist.
Smiles
C([C@@H](C(OCC)=O)N)CC(OCC)=O
Molecular Formula
C9H17NO4
Molecular Weight
203.24
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Glutamic acid diethyl ester

glutamic acid antagonist; RN given refers to (L)-isomer

CAS Number16450-41-2
PubChem CID73961
IUPAC Namediethyl (2S)-2-aminopentanedioate
Molecular FormulaC9H17NO4
Molecular Weight203.24
XLogP0.2
Topological Polar Surface Area78.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count14
Formal Charge0
Complexity193
SMILES
CCOC(=O)CC[C@@H](C(=O)OCC)N
InChI
InChI=1S/C9H17NO4/c1-3-13-8(11)6-5-7(10)9(12)14-4-2/h7H,3-6,10H2,1-2H3/t7-/m0/s1
InChIKey
HERPVHLYIHBEFW-ZETCQYMHSA-N
Chemical Structure
2D Structure
2D structure of Glutamic acid diethyl ester
CAS: 16450-41-2
CID: 73961
Formula: C9H17NO4
MW: 203.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight203.24
XLogP30.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass203.11575802
Monoisotopic Mass203.11575802
Topological Polar Surface Area78.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity193
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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