Name: CAS: 956697-53-3 | Erismodegib, NX70979
Brand: Apollo Scientific
SKU: NX70979-5MG
Price: 203.0 USD
Availability: InStock

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Product Identifiers

Catalog #	NX70979
CAS Number	956697-53-3
PubChem CID	24775005
Chemical Name	Erismodegib
IUPAC Name	N-[6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]pyridin-3-yl]-2-methyl-3-[4-(trifluoromethoxy)phenyl]benzamide
Synonym	Sonidegib, LDE225
InChI	InChI=1S/C26H26F3N3O3/c1-16-14-32(15-17(2)34-16)24-12-9-20(13-30-24)31-25(33)23-6-4-5-22(18(23)3)19-7-10-21(11-8-19)35-26(27,28)29/h4-13,16-17H,14-15H2,1-3H3,(H,31,33)/t16-,17+
InChIKey	VZZJRYRQSPEMTK-CALCHBBNSA-N
SMILES	C[C@@H]1CN(C[C@H](C)O1)c2ccc(cn2)\N=C(/O)\c3cccc(c3C)c4ccc(OC(F)(F)F)cc4
MDL Number	MFCD16038928

Specification

MW	485.5
MF	C26H26F3N3O3
Product Notes	Erismodegib, NVP-LDE225) is a Smoothened (Smo) antagonist, inhibiting Hedgehog (Hh) signaling with IC50 of 1.3 nM (mouse) and 2.5 nM (human) in cell-free assays, respectively.
Cat Number	BISN0158
Manufacturer	Apollo Scientific
Country of Origin	United Kingdom

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