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Monastrol

CAT: 0957-S8439-01Size: 10 mgDry Ice: YesHazardous: No
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CAT#:0957-S8439-01Size:10 mg
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Description
Monastrol ((±) -Monastrol) is a cell-permeable small molecule inhibitor of kinesin-5 (KIF11) with an IC50 of 14μM, which is essential for maintaining separation of the half-spindles.
CAS Number
329689-23-8
Synonyms
(±) -Monastrol
Target
Kinesin
Activity
Cytoskeletal Signaling
Molecular Formula
C14H16N2O3S
Storage Conditions
2 years -80 in solvent

Chemical Information

(+-)-Monastrol

Monastrol is a racemate comprising equimolar amounts of R- and S-monastrol. It has a role as an antineoplastic agent, an EC 3.5.1.5 (urease) inhibitor, an antimitotic and an antileishmanial agent. It contains a (R)-monastrol and a (S)-monastrol.

CAS Number329689-23-8
PubChem CID2987927
IUPAC Nameethyl 4-(3-hydroxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Molecular FormulaC14H16N2O3S
Molecular Weight292.36
XLogP1.6
Topological Polar Surface Area103
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count20
Formal Charge0
Complexity436
SMILES
CCOC(=O)C1=C(NC(=S)NC1C2=CC(=CC=C2)O)C
InChI
InChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,12,17H,3H2,1-2H3,(H2,15,16,20)
InChIKey
LOBCDGHHHHGHFA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (+-)-Monastrol
CAS: 329689-23-8
CID: 2987927
Formula: C14H16N2O3S
MW: 292.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.36
XLogP31.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass292.08816355
Monoisotopic Mass292.08816355
Topological Polar Surface Area103 Ų
Heavy Atom Count20
Formal Charge0
Complexity436
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-101071A-01Monastrol

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