SML0046

NSC 668036 hydrate

≥98% (HPLC)

• Synonym(s): N-[(1,1-Dimethylethoxy)carbonyl]-L-alanyl-(2S)-2-hydroxy-3-methylbutanoyl-L-Alanine-(1S)-1-carboxy-2-methylpropyl ester hydrate, N-[(1,1-Dimethylethoxy)carbonyl]-L-alanyl-(2S)-2-hydroxy-3-methylbutanoyl-L-alanyl-(2S)-2-hydroxy-3-methylbutanoic acid hydrate
• Empirical Formula (Hill Notation): C₂₁H₃₆N₂O₉ · xH₂O
• CAS Number: 144678-63-7
• Molecular Weight: 460.52 (anhydrous basis)
• MDL number: MFCD20036264
• UNSPSC Code: 12352200
• PubChem Substance ID: 329825116
• NACRES: NA.77

Properties

• Assay: ≥98% (HPLC)
• form: powder
• storage condition: desiccated
• color: white to tan
• solubility: H₂O: ≥5 mg/mL
• shipped in: wet ice
• storage temp.: −20°C
• SMILES string: O.CC(C)[C@H](OC(=O)[C@H](C)NC(=O)[C@@H](OC(=O)[C@H](C)NC(=O)OC(C)(C)C)C(C)C)C(O)=O
• InChI: 1S/C21H36N2O9.H2O/c1-10(2)14(30-19(28)13(6)23-20(29)32-21(7,8)9)16(24)22-12(5)18(27)31-15(11(3)4)17(25)26;/h10-15H,1-9H3,(H,22,24)(H,23,29)(H,25,26);1H2/t12-,13-,14-,15-;/m0./s1
• InChI key: CARNRIDSPYICIM-WFGXUCIJSA-N

Description

Application

NSC 668036 hydrate may be used in Wnt-mediated cell signaling studies.

Biochem/physiol Actions

Inhibitor of dishevelled PDZ domain.

NSC 668036 binds to the PDZ domain of the Wnt-pathway signaling molecule Disheveled (Dvl), blocking the binding and activation of Dvl by Frizzled. In Xenopus embryos, NSC 668036 inhibited Wnt3A-induced expression of the target gene Siamois and formation of secondary axes.

Other Notes

hygroscopic

Safety Information

• Storage Class Code: 13 - Non Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable