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Icaritin

CAT: 0013-GTR19160003-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19160003-02Size:500 mg
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Description
Icaritin is an oral traditional Chinese medicine, derived from barrenwort, which targets the estrogen receptor α36. IC50 values for Icaritin are 8,13 and 18 μM for K562, CML-CP and CML-BC cells respectively. Icaritin inhibits the invasion and epithelial-to-mesenchymal transition of glioblastoma cells by targeting EMMPRIN via PTEN/AKt/HIF-1α signalling. Icaritin suppresses hepatocellular carcinoma initiation and malignant growth through the IL-6/Jak2/Stat3 pathway. Icaritin activates JNK-dependent mPTP necrosis pathway in colorectal cancer cells.
CAS Number
118525-40-9
Product Name Alternative
Icaritin
Purity
>98% (HPLC)
Solubility
DMSO : 14 mg/mL 38.00 mM
Smiles
CC (=CCc1c (cc (c2c1oc (c (c2=O) O) c1ccc (cc1) OC) O) O) C
Molecular Formula
C21H20O6
Molecular Weight
368.38
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
3,5,7-Trihydroxy-2- (4-methoxyphenyl) -8- (3-methyl-2-buten-1-yl) -4H-1-benzopyran-4-one

Chemical Information

Icaritin

Icaritin is a member of flavones.

CAS Number118525-40-9
PubChem CID5318980
IUPAC Name3,5,7-trihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one
Molecular FormulaC21H20O6
Molecular Weight368.4
XLogP4.8
Topological Polar Surface Area96.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity612
SMILES
CC(=CCC1=C2C(=C(C=C1O)O)C(=O)C(=C(O2)C3=CC=C(C=C3)OC)O)C
InChI
InChI=1S/C21H20O6/c1-11(2)4-9-14-15(22)10-16(23)17-18(24)19(25)20(27-21(14)17)12-5-7-13(26-3)8-6-12/h4-8,10,22-23,25H,9H2,1-3H3
InChIKey
TUUXBSASAQJECY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Icaritin
CAS: 118525-40-9
CID: 5318980
Formula: C21H20O6
MW: 368.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight368.4
XLogP34.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass368.12598835
Monoisotopic Mass368.12598835
Topological Polar Surface Area96.2 Ų
Heavy Atom Count27
Formal Charge0
Complexity612
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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