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MYCOPHENOLATE SODIUM

CAT: 0013-GTR19259815-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19259815-02Size:100 mg
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Description
Mycophenolic acid sodium is a potent uncompetitive inosine monophosphate dehydrogenase (IMPDH) inhibitor with an EC50 of 0.24 μM.
CAS Number
37415-62-6
Purity
>98% (HPLC)
Molecular Formula
C17H19NaO6
Molecular Weight
342.323
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Mycophenolate Sodium

Mycophenolate sodium is an organic sodium salt that is the sodium salt of mycophenolic acid. An immunosuppressant, it is widely used to prevent tissue rejection following organ transplants and for the treatment of certain autoimmune diseases. It has a role as an immunosuppressive agent and an EC 1.1.1.205 (IMP dehydrogenase) inhibitor. It contains a mycophenolate.

CAS Number37415-62-6
PubChem CID23665584
IUPAC Namesodium (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
Molecular FormulaC17H19NaO6
Molecular Weight342.3
Topological Polar Surface Area95.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity491
SMILES
CC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\C)/CCC(=O)[O-])O.[Na+]
InChI
InChI=1S/C17H20O6.Na/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3;/h4,20H,5-8H2,1-3H3,(H,18,19);/q;+1/p-1/b9-4+;
InChIKey
DOZYTHNHLLSNIK-JOKMOOFLSA-M
Chemical Structure
2D Structure
2D structure of Mycophenolate Sodium
CAS: 37415-62-6
CID: 23665584
Formula: C17H19NaO6
MW: 342.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight342.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass342.10793260
Monoisotopic Mass342.10793260
Topological Polar Surface Area95.9 Ų
Heavy Atom Count24
Formal Charge0
Complexity491
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes