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RA-9

CAT: 0931-T8464-04Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T8464-04Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
919091-63-7
Target
DUB, Apoptosis
Related Pathways
Ubiquitination, Cell Cycle/Checkpoint, Apoptosis, DNA Damage/DNA Repair
Purity
0.9931
Bioactivity
RA-9 is a potent and selective proteasome-associated inhibitor of deubiquitinating enzymes (DUBs) with a favorable toxicity profile and anticancer activity, particularly effective in inducing apoptosis in ovarian cancer cell lines.
Smiles
[O-][N+](=O)c1ccc(\C=C2/CNC\C(=C/c3ccc(cc3)[N+]([O-])=O)C2=O)cc1
Molecular Formula
C19H15N3O5
Molecular Weight
365.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(3E,5E)-3,5-bis(4-nitrobenzylidene)piperidin-4-one
CAS Number919091-63-7
PubChem CID5469266
IUPAC Name(3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]piperidin-4-one
Molecular FormulaC19H15N3O5
Molecular Weight365.3
XLogP2.8
Topological Polar Surface Area121
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count27
Formal Charge0
Complexity591
SMILES
C\1NC/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)/C1=C/C3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C19H15N3O5/c23-19-15(9-13-1-5-17(6-2-13)21(24)25)11-20-12-16(19)10-14-3-7-18(8-4-14)22(26)27/h1-10,20H,11-12H2/b15-9+,16-10+
InChIKey
YUYPWAMLWZVHAE-KAVGSWPWSA-N
Chemical Structure
2D Structure
2D structure of (3E,5E)-3,5-bis(4-nitrobenzylidene)piperidin-4-one
CAS: 919091-63-7
CID: 5469266
Formula: C19H15N3O5
MW: 365.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight365.3
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass365.10117059
Monoisotopic Mass365.10117059
Topological Polar Surface Area121 Ų
Heavy Atom Count27
Formal Charge0
Complexity591
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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