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Curcumin-d6

CAT: 0931-T10901-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T10901-04Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1246833-26-0
Target
Histone Acetyltransferase, Epigenetic Reader Domain, Ferroptosis, Influenza Virus, Autophagy, Mitophagy, Nrf2
Related Pathways
Microbiology/Virology, Immunology/Inflammation, Apoptosis, Chromatin/Epigenetic, Autophagy
Bioactivity
Curcumin D6 (difluoroformylmethane D6) is deuterium-labeled curcumin (Turmeric yellow) . Curcumin (Turmeric yellow) is a natural phenolic compound with various pharmacological effects, including anti-inflammatory, antioxidant, anti-proliferative and anti-angiogenic activities. Curcumin is an inhibitor of p300 histone acetyltransferases (HATs), and also shows inhibitory effects on NF-κB and MAPKs.
Smiles
[2H]C([2H])([2H])Oc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC([2H])([2H])[2H])c2)ccc1O |w:9.9,16.16|
Molecular Formula
C21H20O6
Molecular Weight
374.422
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(1E,6E)-1,7-Bis(4-hydroxy-3-((~2~H_3_)methyloxy)phenyl)hepta-1,6-diene-3,5-dione
CAS Number1246833-26-0
PubChem CID53464495
IUPAC Name(1E,6E)-1,7-bis[4-hydroxy-3-(trideuteriomethoxy)phenyl]hepta-1,6-diene-3,5-dione
Molecular FormulaC21H20O6
Molecular Weight374.4
XLogP3.2
Topological Polar Surface Area93.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count27
Formal Charge0
Complexity507
SMILES
[2H]C(OC1=C(C=CC(=C1)/C=C/C(=O)CC(=O)/C=C/C2=CC(=C(C=C2)O)OC([2H])([2H])[2H])O)([2H])[2H]
InChI
InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+/i1D3,2D3
InChIKey
VFLDPWHFBUODDF-BQWNYRPNSA-N
Chemical Structure
2D Structure
2D structure of (1E,6E)-1,7-Bis(4-hydroxy-3-((~2~H_3_)methyloxy)phenyl)hepta-1,6-diene-3,5-dione
CAS: 1246833-26-0
CID: 53464495
Formula: C21H20O6
MW: 374.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight374.4
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass374.16364883
Monoisotopic Mass374.16364883
Topological Polar Surface Area93.1 Ų
Heavy Atom Count27
Formal Charge0
Complexity507
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes