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Safety Information

SML0046

Sigma-Aldrich

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

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About This Item

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

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

Application

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

Biochem/physiol Actions

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

Storage Class Code

13 - Non Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

JAN Code

SML0046-5MG:
SML0046-VAR:
SML0046-BULK:
SML0046-25MG:

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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