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Emerin

CAT: 0013-GTR19256096-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19256096-01Size:10 mg
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Description
Emerin is an antibiotic found in the Aspergillus nidulans strain.
CAS Number
40581-18-8
Field of Research
Infectious Disease & Virology
Smiles
C (\C (=C\C1=CC=C (OC) C=C1) \C#N) (=C/C2=CC=C (OC) C=C2) /C#N
Molecular Formula
C20H16N2O2
Molecular Weight
316.353
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Emerin

Emerin is a phenylpropanoid.

CAS Number40581-18-8
PubChem CID6442625
IUPAC Name(2Z,3Z)-2,3-bis[(4-methoxyphenyl)methylidene]butanedinitrile
Molecular FormulaC20H16N2O2
Molecular Weight316.4
XLogP3.8
Topological Polar Surface Area66
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity507
SMILES
COC1=CC=C(C=C1)/C=C(/C(=C/C2=CC=C(C=C2)OC)/C#N)\C#N
InChI
InChI=1S/C20H16N2O2/c1-23-19-7-3-15(4-8-19)11-17(13-21)18(14-22)12-16-5-9-20(24-2)10-6-16/h3-12H,1-2H3/b17-11+,18-12+
InChIKey
HCHFRAXBELVCGG-JYFOCSDGSA-N
Chemical Structure
2D Structure
2D structure of Emerin
CAS: 40581-18-8
CID: 6442625
Formula: C20H16N2O2
MW: 316.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight316.4
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass316.121177757
Monoisotopic Mass316.121177757
Topological Polar Surface Area66 Ų
Heavy Atom Count24
Formal Charge0
Complexity507
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-N14749Emerin
20-1747Emerin Antibody
GWB-9393E3Emerin, Antibody
sc-515522Emerin (A-5)
4031PEmerin Peptide
509129Emerin discontinued
sc-81553Emerin (MANEM5)
E2257-01BEmerin (Leu12)
480158EMD (Emerin)

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