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6,8-Diprenylorobol

CAT: 0931-TN1302Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-TN1302Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
66777-70-6
Target
ROS, Antifection, ERK, JNK, Caspase, Akt, Bcl-2 Family, HIV Protease, p38 MAPK, Apoptosis, Reactive Oxygen Species
Related Pathways
Cytoskeletal Signaling, Microbiology/Virology, Metabolism, Proteases/Proteasome, Apoptosis, Immunology/Inflammation, PI3K/Akt/mTOR signaling, MAPK, NF-κB
Bioactivity
6,8-Diprenylorobol possesses weaker anti-H. pylori activity, it may be a useful chemopreventive agent for peptic ulcer or gastric cancer in H. pylori-infected individuals.
Smiles
CC(C)=CCc(c(O)c(CC=C(C)C)c(OC=C1c(cc2)cc(O)c2O)c2C1=O)c2O
Molecular Formula
C25H26O6
Molecular Weight
422.47
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

6,8-Diprenylorobol

6,8-diprenylorobol has been reported in Flemingia macrophylla, Flemingia prostrata, and other organisms with data available.

CAS Number66777-70-6
PubChem CID21148065
IUPAC Name3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)chromen-4-one
Molecular FormulaC25H26O6
Molecular Weight422.5
XLogP6.2
Topological Polar Surface Area107
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity745
SMILES
CC(=CCC1=C(C(=C2C(=C1O)C(=O)C(=CO2)C3=CC(=C(C=C3)O)O)CC=C(C)C)O)C
InChI
InChI=1S/C25H26O6/c1-13(2)5-8-16-22(28)17(9-6-14(3)4)25-21(23(16)29)24(30)18(12-31-25)15-7-10-19(26)20(27)11-15/h5-7,10-12,26-29H,8-9H2,1-4H3
InChIKey
OAUIRSVJXOFAOO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6,8-Diprenylorobol
CAS: 66777-70-6
CID: 21148065
Formula: C25H26O6
MW: 422.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight422.5
XLogP36.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass422.17293854
Monoisotopic Mass422.17293854
Topological Polar Surface Area107 Ų
Heavy Atom Count31
Formal Charge0
Complexity745
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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