CUR 61414

CAS: 334998-36-6

Ref. 3D-FB20593

Product Information

• Name: CUR 61414
• Synonyms: N-[(3S,5S)-1-(1,3-Benzodioxol-5-ylmethyl)-5-(1-piperazinylcarbonyl)-3-pyrrolidinyl]-N-[(3-methoxyphenyl)methyl]-3,3-dimethylbutanami de
• Brand: Biosynth
• Description: Antagonist of hedgehog signaling pathway activator Smoothened; antineoplastic

Chemical properties

• Molecular weight: 550.69 g/mol
• Formula: C₃₁H₄₂N₄O₅
• Purity: Min. 95%
• InChI: InChI=1S/C31H42N4O5/c1-31(2,3)17-29(36)35(19-22-6-5-7-25(14-22)38-4)24-16-26(30(37)33-12-10-32-11-13-33)34(20-24)18-23-8-9-27-28(15-23)40-21-39-27/h5-9,14-15,24,26,32H,10-13,16-21H2,1-4H3/t24-,26-/m0/s1
• InChI key: InChIKey=WPHXYKUPFJRJDK-AHWVRZQESA-N
• SMILES: COc1cccc(CN(C(=O)CC(C)(C)C)[C@H]2C[C@@H](C(=O)N3CCNCC3)N(Cc3ccc4c(c3)OCO4)C2)c1