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Paradol

CAT: 0931-T7113-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T7113-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
27113-22-0
Target
COX
Related Pathways
Immunology/Inflammation, Neuroscience
Purity
0.9943
Bioactivity
Paradol ([6]-Gingerone) is a pungent phenolic substance found in ginger and other Zingiberaceae plants, and exhibits a variety of biological activities including anti-cancer, anti-inflammatory, and anti-oxidative activities, neuroprotective Effects.
Smiles
CCCCCCCC(=O)CCc1ccc(O)c(OC)c1
Molecular Formula
C17H26O3
Molecular Weight
278.39
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Paradol

[6]-Paradol is a ketone, a monomethoxybenzene and a member of phenols.

CAS Number27113-22-0
PubChem CID94378
IUPAC Name1-(4-hydroxy-3-methoxyphenyl)decan-3-one
Molecular FormulaC17H26O3
Molecular Weight278.4
XLogP3.8
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Heavy Atom Count20
Formal Charge0
Complexity265
SMILES
CCCCCCCC(=O)CCC1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C17H26O3/c1-3-4-5-6-7-8-15(18)11-9-14-10-12-16(19)17(13-14)20-2/h10,12-13,19H,3-9,11H2,1-2H3
InChIKey
CZNLTCTYLMYLHL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Paradol
CAS: 27113-22-0
CID: 94378
Formula: C17H26O3
MW: 278.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight278.4
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Exact Mass278.18819469
Monoisotopic Mass278.18819469
Topological Polar Surface Area46.5 Ų
Heavy Atom Count20
Formal Charge0
Complexity265
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes