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Indoximod

CAT: 0931-T6543-04Size: 2 gDry Ice: NoHazardous: No
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CAT#:0931-T6543-04Size:2 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
110117-83-4
Target
Indoleamine 2,3-Dioxygenase (IDO), IDO
Related Pathways
Metabolism
Purity
0.9955
Bioactivity
Indoximod (NLG-8189) is a methylated tryptophan with immune checkpoint inhibitory activity. Indoximod inhibits the enzyme indoleamine 2, 3-dioxygenase (IDO), which degrades the essential amino acid tryptophan, and may increase or maintain tryptophan levels important to T cell function. Tryptophan depletion is associated with immunosuppression involving T cell arrest and anergy.
Smiles
Cn1cc(C[C@@H](N)C(O)=O)c2ccccc12
Molecular Formula
C12H14N2O2
Molecular Weight
218.25
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Indoximod

Indoximod is an indolyl carboxylic acid.

CAS Number110117-83-4
PubChem CID405012
IUPAC Name(2R)-2-amino-3-(1-methylindol-3-yl)propanoic acid
Molecular FormulaC12H14N2O2
Molecular Weight218.25
XLogP-1.3
Topological Polar Surface Area68.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count16
Formal Charge0
Complexity270
SMILES
CN1C=C(C2=CC=CC=C21)C[C@H](C(=O)O)N
InChI
InChI=1S/C12H14N2O2/c1-14-7-8(6-10(13)12(15)16)9-4-2-3-5-11(9)14/h2-5,7,10H,6,13H2,1H3,(H,15,16)/t10-/m1/s1
InChIKey
ZADWXFSZEAPBJS-SNVBAGLBSA-N
Chemical Structure
2D Structure
2D structure of Indoximod
CAS: 110117-83-4
CID: 405012
Formula: C12H14N2O2
MW: 218.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight218.25
XLogP3-1.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass218.105527694
Monoisotopic Mass218.105527694
Topological Polar Surface Area68.3 Ų
Heavy Atom Count16
Formal Charge0
Complexity270
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
C12922-200mgIndoximod
C6586-200(S)-Indoximod
GTR19170111(S) -Indoximod
A4747-100(Rac)-Indoximod
HY-133897-01(Rac) -Indoximod
HY-16724R-01Indoximod (Standard)
A14397-500Indoximod 500mg
A14397-100Indoximod 100mg
B4900-200Indoximod (NLG-8189)

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