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Pinosylvin monomethyl ether

CAT: 0931-TN3907-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-TN3907-01Size:1 mg
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CAS Number
35302-70-6
Target
Others
Related Pathways
Others
Purity
0.9996
Bioactivity
Pinosylvin monomethyl ether is an aromatic compound demonstrating inhibitory activity against A2780, J774, and HEK293 cells.
Smiles
COc1cc(O)cc(\C=C\c2ccccc2)c1
Molecular Formula
C15H14O2
Molecular Weight
226.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pinosylvin monomethyl ether

Pinosylvin methyl ether is a stilbenoid.

CAS Number35302-70-6
PubChem CID5281719
IUPAC Name3-methoxy-5-[(E)-2-phenylethenyl]phenol
Molecular FormulaC15H14O2
Molecular Weight226.27
XLogP3.8
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity243
SMILES
COC1=CC(=CC(=C1)O)/C=C/C2=CC=CC=C2
InChI
InChI=1S/C15H14O2/c1-17-15-10-13(9-14(16)11-15)8-7-12-5-3-2-4-6-12/h2-11,16H,1H3/b8-7+
InChIKey
JVIXPWIEOVZVJC-BQYQJAHWSA-N
Chemical Structure
2D Structure
2D structure of Pinosylvin monomethyl ether
CAS: 35302-70-6
CID: 5281719
Formula: C15H14O2
MW: 226.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight226.27
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass226.099379685
Monoisotopic Mass226.099379685
Topological Polar Surface Area29.5 Ų
Heavy Atom Count17
Formal Charge0
Complexity243
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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TB00238Pinosylvin monomethyl ether
HY-N3056RPinosylvin monomethyl ether (Standard)
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HY-134990-01Hematoporphyrin monomethyl ether
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