Products for Research Use Only

Octahydrocurcumin

CAT: 0013-GTR19170130-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19170130-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Octahydrocurcumin is a bioactive small molecule with antioxidant and anti-inflammatory properties, demonstrated to suppress LPS-induced inflammation by inhibiting NF-κB nuclear translocation. It exhibits cytotoxic (IC50 = 19.46 μg/mL) and antimicrobial activities, making it a useful research tool for studying inflammatory pathways and infection models in vitro.
CAS Number
36062-07-4
Product Name Alternative
NFkB, Octahydrocurcumin, NF-κB, NF-kB, NFκB, inhibit, Hexahydrobisdemethoxycurcumin, Inhibitor, Antiinfection, Anti-infection, Antifection, Reactive Oxygen Species, ReactiveOxygenSpecies, ROS
Field of Research
Immunology & Inflammation, Infectious Disease & Virology, Metabolism Research, Signal Transduction
Purity
99.54% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:3.3 mg/mL (8.77 mM) ; Ethanol:10 mg/mL (26.56 mM) ; DMSO:100 mg/mL (265.65 mM)
Smiles
COc1cc (CCC (O) CC (O) CCc2ccc (O) c (OC) c2) ccc1O
Molecular Formula
C21H28O6
Molecular Weight
376.44
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Octahydrocurcumin

Octahydrocurcumin has been reported in Zingiber officinale with data available.

CAS Number36062-07-4
PubChem CID11068834
IUPAC Name1,7-bis(4-hydroxy-3-methoxyphenyl)heptane-3,5-diol
Molecular FormulaC21H28O6
Molecular Weight376.4
XLogP3.2
Topological Polar Surface Area99.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count27
Formal Charge0
Complexity370
SMILES
COC1=C(C=CC(=C1)CCC(CC(CCC2=CC(=C(C=C2)O)OC)O)O)O
InChI
InChI=1S/C21H28O6/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/h5-6,9-12,16-17,22-25H,3-4,7-8,13H2,1-2H3
InChIKey
OELMAFBLFOKZJD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Octahydrocurcumin
CAS: 36062-07-4
CID: 11068834
Formula: C21H28O6
MW: 376.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight376.4
XLogP33.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass376.18858861
Monoisotopic Mass376.18858861
Topological Polar Surface Area99.4 Ų
Heavy Atom Count27
Formal Charge0
Complexity370
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes