Products for Research Use Only

Alnustone

CAT: 0013-GTR19159868-02Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19159868-02Size:200 mg
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Description
Alnustone exerts significant anti-inflammatory activity in the assay of carrageenin-induced hind paw edema in rats.
CAS Number
33457-62-4
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 100 mg/mL (381.17 mM)
Smiles
C1=CC=C (C=C1) CCC (=O) C=CC=CC2=CC=CC=C2
Molecular Formula
C19H18O
Molecular Weight
262.35
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

(4E,6E)-1,7-Diphenylhepta-4,6-Dien-3-One

Alnustone is a diarylheptanoid.

CAS Number33457-62-4
PubChem CID5317598
IUPAC Name(4E,6E)-1,7-diphenylhepta-4,6-dien-3-one
Molecular FormulaC19H18O
Molecular Weight262.3
XLogP4.6
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count6
Heavy Atom Count20
Formal Charge0
Complexity328
SMILES
C1=CC=C(C=C1)CCC(=O)/C=C/C=C/C2=CC=CC=C2
InChI
InChI=1S/C19H18O/c20-19(16-15-18-11-5-2-6-12-18)14-8-7-13-17-9-3-1-4-10-17/h1-14H,15-16H2/b13-7+,14-8+
InChIKey
OWMJDOUOHDOUFG-FNCQTZNRSA-N
Chemical Structure
2D Structure
2D structure of (4E,6E)-1,7-Diphenylhepta-4,6-Dien-3-One
CAS: 33457-62-4
CID: 5317598
Formula: C19H18O
MW: 262.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight262.3
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count6
Exact Mass262.135765193
Monoisotopic Mass262.135765193
Topological Polar Surface Area17.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity328
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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