[CAS NO. 2098890-15-2] SMS2-IN-1
PRODUCTS SPECIFICATIONS [2098890-15-2]
DESCRIPTION [2098890-15-2]
Overview
| MDL | MFCD31813610 |
|---|---|
| Molecular Weight | 681.67 |
| Molecular Formula | C34H37F6N3O5 |
| SMILES | O=C1C(C(N(CC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)C)=O)=C(OCCCC3CCN(C(OC4(CC4)C)=O)CC3)C5=CC=CC=C5N1C |
Summary
SMS2-IN-1 is a potent and highly selective sphingomyelin synthase 2 (SMS2) inhibitor with an IC 50 of 6.5 nM and a K d of 37 nM. SMS2-IN-1 shows 150-fold selectivity for SMS2 over SMS1 (IC 50 of 1000 nM) [1] .
In Vitro
AS/MS binding experiments are conducted using these SMS2-mutant membrane fractions, SMS2-IN-1 (compound 2) binds to the S217A, H272A, and D276A mutants. S227 and H229 are pivotal amino acid residues for the binding of SMS2-IN-1 to SMS2 [1] .
MCE has not independently confirmed the accuracy of these methods. They are for reference only.
Appearance
Solid
Shipping
Room temperature in continental US; may vary elsewhere.
Storage
| Powder | -20°C | 3 years |
|---|---|---|
| 4°C | 2 years | |
| In solvent | -80°C | 6 months |
| -20°C | 1 month |
Solvent & Solubility
DMSO : 27.78 mg/mL ( 40.75 mM ; Need ultrasonic)
Stock Solutions
| Concentration Solvent Mass | 1 mg | 5 mg | 10 mg |
|---|
| 1 mM | 1.4670 mL | 7.3349 mL | 14.6699 mL |
| 5 mM | 0.2934 mL | 1.4670 mL | 2.9340 mL |
| 10 mM | 0.1467 mL | 0.7335 mL | 1.4670 mL |
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1.
Add each solvent one by one: 10% DMSO >> 90% corn oil
Solubility: ≥ 2.5 mg/mL (3.67 mM); Clear solution
