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Luminespib mesylate

CAT: 0931-T68760-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T68760-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
747412-64-2
Target
Others
Related Pathways
Others
Bioactivity
Luminespib, also known as AUY-922, NVP-AUY922, VER52296, is a derivative of 4,5-diarylisoxazole and a third-generation heat shock protein 90 (Hsp90) inhibitor with potential antineoplastic activity. Hsp90 inhibitor AUY922 has been shown to bind with high affinity to and inhibit Hsp90, resulting in the proteasomal degradation of oncogenic client proteins; the inhibition of cell proliferation; and the elevation of heat shock protein 72 (Hsp72) in a wide range of human tumor cell lines.
Smiles
C(NCC)(=O)C=1C(=C(ON1)C2=CC(C(C)(C)C)=C(O)C=C2O)C3=CC=C(CN4CCOCC4)C=C3
Molecular Formula
C27H33N3O5
Molecular Weight
479.57
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Auy922

AUY922 has been used in trials studying the treatment of Lymphoma, Breast Cancer, Metastatic Disease, Advanced Solid Tumors, and Hematologic Neoplasms, among others.

CAS Number747412-64-2
PubChem CID135545855
IUPAC Name5-(5-tert-butyl-2,4-dihydroxyphenyl)-N-ethyl-4-[4-(morpholin-4-ylmethyl)phenyl]-1,2-oxazole-3-carboxamide
Molecular FormulaC27H33N3O5
Molecular Weight479.6
XLogP4.1
Topological Polar Surface Area108
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count35
Formal Charge0
Complexity687
SMILES
CCNC(=O)C1=NOC(=C1C2=CC=C(C=C2)CN3CCOCC3)C4=CC(=C(C=C4O)O)C(C)(C)C
InChI
InChI=1S/C27H33N3O5/c1-5-28-26(33)24-23(18-8-6-17(7-9-18)16-30-10-12-34-13-11-30)25(35-29-24)19-14-20(27(2,3)4)22(32)15-21(19)31/h6-9,14-15,31-32H,5,10-13,16H2,1-4H3,(H,28,33)
InChIKey
WLYWTGDTMWWNNG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Auy922
CAS: 747412-64-2
CID: 135545855
Formula: C27H33N3O5
MW: 479.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight479.6
XLogP34.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass479.24202116
Monoisotopic Mass479.24202116
Topological Polar Surface Area108 Ų
Heavy Atom Count35
Formal Charge0
Complexity687
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS5811319Luminespib mesylate
FL137696-01Luminespib
HY-10215R-01Luminespib (Standard)
HY-10976Luminespib analog
TBI4672-25MGLuminespib, HSP90 inhibitor
C07489-25mgLuminespib (NVP-AUY922)
200371Luminespib (AUY-922 )
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A10659-50AUY922 (Luminespib, NVP-AUY922) 50mg
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