(±)-SHIN2

(±)-SHIN2 is a racemic mixture of (+)-SHIN2, a serine hydroxymethyltransferase 1 (SHMT1) and SHMT2 inhibitor, and (-)-SHIN2, the inactive isomer of (+)-SHIN2. Formal Name: 6-amino-1,4-dihydro-4-[3-(hydroxymethyl)-5-(5-hydroxy-1-pentyn-1-yl)phenyl]-3-methyl-4-(1-methylethyl)-pyrano[2,3-c]pyrazole-5-carbonitrile. CAS Number: 2204289-53-0. Molecular Formula: C23H26N4O3. Formula Weight: 406.5. Purity: >98%. Formulation (Request formulation change): A solid. Solubility: Acetonitrile: Slightly soluble: 0.1-1 mg/ml DMSO: Slightly soluble: 0.1-1 mg/ml. SMILES: N#CC1=C(N)OC2=C(C1(C(C)C)C3=CC(CO)=CC(C#CCCCO)=C3)C(C)=NN2. InChi Code: InChI=1S/C23H26N4O3/c1-14(2)23(19(12-24)21(25)30-22-20(23)15(3)26-27-22)18-10-16(7-5-4-6-8-28)9-17(11-18)13-29/h9-11,14,28-29H,4,6,8,13,25H2,1-3H3,(H,26,27). InChi Key: IWUCUJZMKDHLOF-UHFFFAOYSA-N. Storage: -20°C. Stability: > 4 years.