CM037

CM037 is a selective inhibitor of aldehyde dehydrogenase 1A1 (ALDH1A1, IC50 = 4.6 µM). It is selective for ALDH1A1 over eight other ALDH isoenzymes at a concentration of 20 µM. CM037 is a competitive inhibitor against acetaldehyde with a Ki value of 0.23 µM.Formal Name: 2-[[3,4-dihydro-4-oxo-3-[3-(1-pyrrolidinyl)propyl][1]benzothieno[3,2-d]pyrimidin-2-yl]thio]-acetic acid, ethyl ester. CAS Number: 896795-60-1. Molecular Formula: C21H25N3O3S2. Formula Weight: 431.6. Purity: >98%. Formulation: (Request formulation change), A crystalline solid. Solubility: DMF: 10 mg/ml, DMF:PBS (pH 7.2), (1:7): 0.125 mg/ml, DMSO: 2.5 mg/ml. lambdamax: 254, 334, 348 nm. SMILES: O=C1N(CCCN2CCCC2)C(SCC(OCC)=O)=NC3=C1SC4=C3C=CC=C4. InChi Code: InChI=1S/C21H25N3O3S2/c1-2-27-17(25)14-28-21-22-18-15-8-3-4-9-16(15)29-19(18)20(26)24(21)13-7-12-23-10-5-6-11-23/h3-4,8-9H,2,5-7,10-14H2,1H3. InChi Key: SKDRHRAYBYQVNU-UHFFFAOYSA-N.