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LY389795

CAT: 0013-GTR19197147-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19197147-02Size:50 mg
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Description
LY389795 is a selective mGlu2/3 receptor agonist used in preclinical research. It is employed in both in vitro and in vivo studies to investigate the role of group II metabotropic glutamate receptors in mechanisms of inflammatory pain and related neurological pathways.
CAS Number
222529-89-7
Smiles
C (O) (=O) [C@@]1 (N) [C@@]2 ([C@@H] (C (O) =O) [C@@]2 (SC1) [H]) [H]
Molecular Formula
C7H9NO4S
Molecular Weight
203.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

LY-389795

a group II metabotropic glutamate receptor agonist; structure in first source

CAS Number222529-89-7
PubChem CID10058694
IUPAC Name(4S,6S)-4-amino-2-thiabicyclo[3.1.0]hexane-4,6-dicarboxylic acid
Molecular FormulaC7H9NO4S
Molecular Weight203.22
XLogP-3.5
Topological Polar Surface Area126
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity294
SMILES
C1[C@](C2[C@H](C2S1)C(=O)O)(C(=O)O)N
InChI
InChI=1S/C7H9NO4S/c8-7(6(11)12)1-13-4-2(3(4)7)5(9)10/h2-4H,1,8H2,(H,9,10)(H,11,12)/t2-,3?,4?,7+/m1/s1
InChIKey
QBHIOYZCUZBIEN-RSWQVWFLSA-N
Chemical Structure
2D Structure
2D structure of LY-389795
CAS: 222529-89-7
CID: 10058694
Formula: C7H9NO4S
MW: 203.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight203.22
XLogP3-3.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass203.02522894
Monoisotopic Mass203.02522894
Topological Polar Surface Area126 Ų
Heavy Atom Count13
Formal Charge0
Complexity294
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T27950-01LY389795

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