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Demethoxycurcumin

CAT: 1410-M18268-05Size: 200 mgDry Ice: NoHazardous: No
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CAT#:1410-M18268-05Size:200 mg
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Description
Demethoxycurcumin is a potential additive natural product in combination with chemotherapeutic agents in drug-resistant cancers.
CAS Number
22608-11-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
338.35
Molecular Formula
C20H18O5
Notes
Research use only, not for human use.
Receptor
Antioxidant

Chemical Information

Demethoxycurcumin

Demethoxycurcumin is a beta-diketone that is curcumin in which one of the methoxy groups is replaced by hydrogen. It is found in Curcuma zedoaria and Etlingera elatior. It has a role as a metabolite, an antineoplastic agent and an anti-inflammatory agent. It is a polyphenol, an enone, a beta-diketone and a diarylheptanoid.

CAS Number22608-11-3
PubChem CID5469424
IUPAC Name(1E,6E)-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione
Molecular FormulaC20H18O5
Molecular Weight338.4
XLogP3.3
Topological Polar Surface Area83.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count25
Formal Charge0
Complexity502
SMILES
COC1=C(C=CC(=C1)/C=C/C(=O)CC(=O)/C=C/C2=CC=C(C=C2)O)O
InChI
InChI=1S/C20H18O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-12,21,24H,13H2,1H3/b9-4+,10-5+
InChIKey
HJTVQHVGMGKONQ-LUZURFALSA-N
Chemical Structure
2D Structure
2D structure of Demethoxycurcumin
CAS: 22608-11-3
CID: 5469424
Formula: C20H18O5
MW: 338.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight338.4
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass338.11542367
Monoisotopic Mass338.11542367
Topological Polar Surface Area83.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity502
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

Alternative Products

CatalogName
FD20982-01Demethoxycurcumin
HY-N0006R-01Demethoxycurcumin (Standard)
HY-N0006S-01Demethoxycurcumin-d7
371357Demethoxycurcumin discontinued
A14545-50Demethoxycurcumin 50mg
A14545-10Demethoxycurcumin 10mg
A14545-1Demethoxycurcumin 1mg

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