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Corynoxeine

CAT: 0931-T6S0655-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T6S0655-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
630-94-4
Target
ERK
Related Pathways
MAPK
Purity
0.9994
Bioactivity
1. Corynoxeine is a potent ERK1/2 inhibitor of key PDGF-BB-induced VSMC proliferation and may be useful in the prevention and treatment of vascular diseases and restenosis after angioplasty.
Smiles
CO\C=C(/[C@H]1C[C@@H]2N(CC[C@]22C(=O)Nc3ccccc23)C[C@@H]1C=C)C(=O)OC
Molecular Formula
C22H26N2O4
Molecular Weight
382.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Corynoxeine

Corynoxeine is a member of indoles.

CAS Number630-94-4
PubChem CID44568160
IUPAC Namemethyl (E)-2-[(3R,6'R,7'S,8'aS)-6'-ethenyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate
Molecular FormulaC22H26N2O4
Molecular Weight382.5
XLogP2.1
Topological Polar Surface Area67.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity690
SMILES
CO/C=C(\[C@H]1C[C@H]2[C@@]3(CCN2C[C@@H]1C=C)C4=CC=CC=C4NC3=O)/C(=O)OC
InChI
InChI=1S/C22H26N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h4-8,13-15,19H,1,9-12H2,2-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22+/m0/s1
InChIKey
MUVGVMUWMAGNSY-KAXDATADSA-N
Chemical Structure
2D Structure
2D structure of Corynoxeine
CAS: 630-94-4
CID: 44568160
Formula: C22H26N2O4
MW: 382.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.5
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass382.18925731
Monoisotopic Mass382.18925731
Topological Polar Surface Area67.9 Ų
Heavy Atom Count28
Formal Charge0
Complexity690
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TB0252-0200Corynoxeine
HY-N0590RCorynoxeine (Standard)
A14658-500Corynoxeine 500mg
A14658-10Corynoxeine 10mg
A14658-5Corynoxeine 5mg
A14658-1Corynoxeine 1mg
A14658-100Corynoxeine 100mg
A14658-50Corynoxeine 50mg
A14658-25Corynoxeine 25mg
371311Corynoxeine discontinued

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