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Gingerdione

CAT: 0013-GTR19237421-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19237421-01Size:10 mg
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Description
Gingerdione is a natural small molecule isolated from turmeric rhizomes that acts as a prostaglandin synthesis inhibitor. It is utilized in biochemical research to study inflammatory pathways and cyclooxygenase activity in both in vitro and in vivo experimental models.
CAS Number
61871-71-4
Smiles
O=C (CC (=O) CCCCC) CCC1=CC=C (O) C (OC) =C1
Molecular Formula
C17H24O4
Molecular Weight
292.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Gingerdione

[6]-Gingerdione is a monomethoxybenzene, a member of phenols and a beta-diketone.

CAS Number61871-71-4
PubChem CID162952
IUPAC Name1-(4-hydroxy-3-methoxyphenyl)decane-3,5-dione
Molecular FormulaC17H24O4
Molecular Weight292.4
XLogP2.6
Topological Polar Surface Area63.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Heavy Atom Count21
Formal Charge0
Complexity327
SMILES
CCCCCC(=O)CC(=O)CCC1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C17H24O4/c1-3-4-5-6-14(18)12-15(19)9-7-13-8-10-16(20)17(11-13)21-2/h8,10-11,20H,3-7,9,12H2,1-2H3
InChIKey
KMNVXQHNIWUUSE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Gingerdione
CAS: 61871-71-4
CID: 162952
Formula: C17H24O4
MW: 292.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.4
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Exact Mass292.16745924
Monoisotopic Mass292.16745924
Topological Polar Surface Area63.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity327
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

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HY-N12643-01Gingerdione
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M31246-011-Dehydro-6-gingerdione
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