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Angoline

CAT: 0931-TN6739-03Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-TN6739-03Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
21080-31-9
Target
Interleukin, STAT, IL Receptor
Related Pathways
JAK/STAT signaling, Immunology/Inflammation, Stem Cells
Purity
0.9996
Bioactivity
Angoline (6-Methoxyldihydrochelerythrine) hydrochloride is a potent and selective IL6/STAT3 signaling pathway inhibitor (IC50 : 11.56 μM) . It inhibits STAT3 phosphorylation and its target gene expression, and inhibits cancer cell proliferation.
Smiles
COC1N(C)c2c(ccc3cc4OCOc4cc23)-c2ccc(OC)c(OC)c12
Molecular Formula
C22H21NO5
Molecular Weight
379.41
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

12,13-Dihydro-1,2,13-trimethoxy-12-methyl(1,3)benzodioxolo(5,6-c)phenanthridine

Angoline is a benzophenanthridine alkaloid.

CAS Number21080-31-9
PubChem CID189060
IUPAC Name1,2,13-trimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridine
Molecular FormulaC22H21NO5
Molecular Weight379.4
XLogP4.2
Topological Polar Surface Area49.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count28
Formal Charge0
Complexity561
SMILES
CN1C(C2=C(C=CC(=C2OC)OC)C3=C1C4=CC5=C(C=C4C=C3)OCO5)OC
InChI
InChI=1S/C22H21NO5/c1-23-20-14(6-5-12-9-17-18(10-15(12)20)28-11-27-17)13-7-8-16(24-2)21(25-3)19(13)22(23)26-4/h5-10,22H,11H2,1-4H3
InChIKey
LVWAKZBZWYHYCJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 12,13-Dihydro-1,2,13-trimethoxy-12-methyl(1,3)benzodioxolo(5,6-c)phenanthridine
CAS: 21080-31-9
CID: 189060
Formula: C22H21NO5
MW: 379.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight379.4
XLogP34.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass379.14197277
Monoisotopic Mass379.14197277
Topological Polar Surface Area49.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity561
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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