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Bavachalcone

CAS No.:
28448-85-3
Catalog Number:
AG00BF5L
Molecular Formula:
C20H20O4
Molecular Weight:
324.3704
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$404
- +
10mg
99%
1 week
United States
$585
- +
Product Description
Catalog Number:
AG00BF5L
Chemical Name:
Bavachalcone
CAS Number:
28448-85-3
Molecular Formula:
C20H20O4
Molecular Weight:
324.3704
MDL Number:
MFCD18427734
IUPAC Name:
(E)-1-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
InChI:
InChI=1S/C20H20O4/c1-13(2)3-7-15-11-17(20(24)12-19(15)23)18(22)10-6-14-4-8-16(21)9-5-14/h3-6,8-12,21,23-24H,7H2,1-2H3/b10-6+
InChI Key:
BLZGPHNVMRXDCB-UXBLZVDNSA-N
SMILES:
CC(=CCc1cc(C(=O)/C=C/c2ccc(cc2)O)c(cc1O)O)C
Properties
Complexity:
470  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
324.136g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
324.376g/mol
Monoisotopic Mass:
324.136g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Literature
Title Journal
Bavachalcone-induced manganese superoxide dismutase expression through the AMP-activated protein kinase pathway in human endothelial cells. Pharmacology 20150101
[Study on the chemical constituents of Psoralea corylifolia]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials 20110801
Bavachalcone inhibits osteoclast differentiation through suppression of NFATc1 induction by RANKL. Biochemical pharmacology 20080601
Prenylflavones from Psoralea corylifolia inhibit nitric oxide synthase expression through the inhibition of I-kappaB-alpha degradation in activated microglial cells. Biological & pharmaceutical bulletin 20051201
Aromatase inhibitors from Broussonetia papyrifera. Journal of natural products 20011001
Cytotoxic activity of low molecular weight polyphenols against human oral tumor cell lines. Anticancer research 20000101
Properties