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23624-21-7 | 4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-[2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-2-yl)phenyl]-2-(4-methoxyphenyl)-
CAS No: 23624-21-7 Catalog No: AG002NXQ MDL No:MFCD20260415
Product Description
Catalog Number:
AG002NXQ
Chemical Name:
4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-[2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-2-yl)phenyl]-2-(4-methoxyphenyl)-
CAS Number:
23624-21-7
Molecular Formula:
C32H22O10
Molecular Weight:
566.5111
MDL Number:
MFCD20260415
IUPAC Name:
5,7-dihydroxy-8-[2-hydroxy-5-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenyl]-2-(4-methoxyphenyl)chromen-4-one
InChI:
InChI=1S/C32H22O10/c1-39-17-6-3-15(4-7-17)26-14-25(38)31-23(36)12-22(35)29(32(31)42-26)19-9-16(5-8-20(19)33)27-13-24(37)30-21(34)10-18(40-2)11-28(30)41-27/h3-14,33-36H,1-2H3
InChI Key:
GZTVUTQZSAZUIY-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cc(=O)c2c(o1)c(c(cc2O)O)c1cc(ccc1O)c1cc(=O)c2c(o1)cc(cc2O)OC
Properties
Complexity:
1080
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
566.121g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
566.518g/mol
Monoisotopic Mass:
566.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
152A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
Literature
| Title | Journal |
|---|---|
| Seco-terpenoids and other constituents from Elateriospermum tapos. | Journal of natural products 20080201 |
| Antiviral amentoflavone from Selaginella sinensis. | Biological & pharmaceutical bulletin 20010301 |
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