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Memagal

CAT: 0013-GTR19274952-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19274952-02Size:10 mg
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Description
Memagal is an AchE inhibitor with an IC50 of 1.16 nM and an NMDAR antagonist with a Ki of 4.6 μM. It effectively suppresses NMDA-induced neurotoxicity, exhibiting an IC50 value of 0.28 nM. Memagal is applicable in Alzheimer's disease research.
CAS Number
1402938-19-5
Smiles
O (C) C1=C2C=3[C@]4 ([C@@] (O2) (C[C@@H] (O) C=C4) [H]) CCN (CCCCCCNC56CC7 (C) CC (C) (C5) CC (C6) C7) CC3C=C1
Molecular Formula
C34H50N2O3
Molecular Weight
534.79
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Memagal
CAS Number1402938-19-5
PubChem CID71450067
IUPAC Name(1S,12S,14R)-4-[6-[(3,5-dimethyl-1-adamantyl)amino]hexyl]-9-methoxy-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol
Molecular FormulaC34H50N2O3
Molecular Weight534.8
XLogP6.3
Topological Polar Surface Area54
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count39
Formal Charge0
Complexity919
SMILES
CC12CC3CC(C1)(CC(C3)(C2)NCCCCCCN4CC[C@@]56C=C[C@@H](C[C@@H]5OC7=C(C=CC(=C67)C4)OC)O)C
InChI
InChI=1S/C34H50N2O3/c1-31-17-24-18-32(2,21-31)23-33(19-24,22-31)35-13-6-4-5-7-14-36-15-12-34-11-10-26(37)16-28(34)39-30-27(38-3)9-8-25(20-36)29(30)34/h8-11,24,26,28,35,37H,4-7,12-23H2,1-3H3/t24?,26-,28-,31?,32?,33?,34-/m0/s1
InChIKey
LUJPPSLEDAYBGR-WDOOIYNRSA-N
Chemical Structure
2D Structure
2D structure of Memagal
CAS: 1402938-19-5
CID: 71450067
Formula: C34H50N2O3
MW: 534.8
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight534.8
XLogP36.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass534.38214346
Monoisotopic Mass534.38214346
Topological Polar Surface Area54 Ų
Heavy Atom Count39
Formal Charge0
Complexity919
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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