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SN05

CAT: 0931-T60768-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T60768-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2768663-51-8
Target
ASCT, Others, transporter
Related Pathways
Others, Membrane transporter/Ion channel, Metabolism
Bioactivity
SN05 is a potent inhibitor of amino acid transport (AAT) that can be used in anticancer research. The Ki values of SN05 for human ASCT1, rat ASCT2, human ASCT2, EAAT1, EAAT2, EAAC1 and EAAT5 is 2.77 μM, 0.73 μM, 0.87 μM, 3.7 μM, 7.25 μM, 7.23 μM and 2.22 μM, respectively [1].
Smiles
C(O[C@H]1C[C@@H](C(O)=O)NC1)(=O)C2=CC=C(C=C2)C3=CC=CC=C3
Molecular Formula
C18H17NO4
Molecular Weight
311.33
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(2~{S},4~{S})-4-(4-phenylphenyl)carbonyloxypyrrolidine-2-carboxylic acid
CAS Number2768663-51-8
PubChem CID156599525
IUPAC Name(2S,4S)-4-(4-phenylbenzoyl)oxypyrrolidine-2-carboxylic acid
Molecular FormulaC18H17NO4
Molecular Weight311.3
XLogP0.5
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity425
SMILES
C1[C@@H](CN[C@@H]1C(=O)O)OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H17NO4/c20-17(21)16-10-15(11-19-16)23-18(22)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9,15-16,19H,10-11H2,(H,20,21)/t15-,16-/m0/s1
InChIKey
GCIZCIZLSHSWDS-HOTGVXAUSA-N
Chemical Structure
2D Structure
2D structure of (2~{S},4~{S})-4-(4-phenylphenyl)carbonyloxypyrrolidine-2-carboxylic acid
CAS: 2768663-51-8
CID: 156599525
Formula: C18H17NO4
MW: 311.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight311.3
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass311.11575802
Monoisotopic Mass311.11575802
Topological Polar Surface Area75.6 Ų
Heavy Atom Count23
Formal Charge0
Complexity425
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19187696-01SN05

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