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RA190

CAT: 0931-T13858-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T13858-06Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1617495-03-0
Target
Proteasome
Related Pathways
Proteases/Proteasome, Ubiquitination
Purity
0.977
Bioactivity
RA190 inhibits proteasome function by covalently binding to cysteine 88 of ubiquitin receptor RPN13.
Smiles
Cl.N[C@@H](Cc1ccccc1)C(=O)N1C\C(=C\c2ccc(Cl)c(Cl)c2)C(=O)\C(C1)=C/c1ccc(Cl)c(Cl)c1
Molecular Formula
C28H23Cl5N2O2
Molecular Weight
596.76
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-(L-phenylalanyl)-3,5-bis(3,4-dichlorobenzylidene)piperidin-4-one hydrochloride
CAS Number1617495-03-0
PubChem CID126843229
IUPAC Name(3Z,5Z)-1-[(2S)-2-amino-3-phenylpropanoyl]-3,5-bis[(3,4-dichlorophenyl)methylidene]piperidin-4-one;hydrochloride
Molecular FormulaC28H23Cl5N2O2
Molecular Weight596.8
Topological Polar Surface Area63.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count37
Formal Charge0
Complexity808
SMILES
C\1N(C/C(=C/C2=CC(=C(C=C2)Cl)Cl)/C(=O)/C1=C\C3=CC(=C(C=C3)Cl)Cl)C(=O)[C@@H](N)CC4=CC=CC=C4.Cl
InChI
InChI=1S/C28H22Cl4N2O2.ClH/c29-22-8-6-18(12-24(22)31)10-20-15-34(28(36)26(33)14-17-4-2-1-3-5-17)16-21(27(20)35)11-19-7-9-23(30)25(32)13-19;/h1-13,26H,14-16,33H2;1H/b20-10-,21-11-;/t26-;/m0./s1
InChIKey
UMWXLEVUBFNYIK-VCCJZKHWSA-N
Chemical Structure
2D Structure
2D structure of 1-(L-phenylalanyl)-3,5-bis(3,4-dichlorobenzylidene)piperidin-4-one hydrochloride
CAS: 1617495-03-0
CID: 126843229
Formula: C28H23Cl5N2O2
MW: 596.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight596.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass596.017266
Monoisotopic Mass594.020216
Topological Polar Surface Area63.4 Ų
Heavy Atom Count37
Formal Charge0
Complexity808
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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