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Home Other Building Blocks 2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-tridecyl-

2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-tridecyl-

CAS No.:
19833-82-0
Catalog Number:
AG002BFH
Molecular Formula:
C20H32O4
Molecular Weight:
336.4657
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50mg
1 week
United States
$403
- +
100mg
1 week
United States
$767
- +
Product Description
Catalog Number:
AG002BFH
Chemical Name:
2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-tridecyl-
CAS Number:
19833-82-0
Molecular Formula:
C20H32O4
Molecular Weight:
336.4657
MDL Number:
MFCD07782229
IUPAC Name:
2-hydroxy-5-methoxy-3-tridecylcyclohexa-2,5-diene-1,4-dione
InChI:
InChI=1S/C20H32O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-19(22)17(21)15-18(24-2)20(16)23/h15,22H,3-14H2,1-2H3
InChI Key:
FRAFMLCDGYVHNZ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC1=C(O)C(=O)C=C(C1=O)OC
Properties
Complexity:
474  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.23g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
336.472g/mol
Monoisotopic Mass:
336.23g/mol
Rotatable Bond Count:
13  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8  
Literature
Title Journal
Chromatographic separation and in vitro activity of sorgoleone congeners from the roots of sorghum bicolor. Journal of agricultural and food chemistry 20031217
Inhibitory effects of sudanese medicinal plant extracts on hepatitis C virus (HCV) protease. Phytotherapy research : PTR 20001101
Properties