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17623-99-3 | 9H-Xanthen-9-one, 1,4-dihydroxy-
CAS No: 17623-99-3 Catalog No: AG0024IE MDL No:
Product Description
Catalog Number:
AG0024IE
Chemical Name:
9H-Xanthen-9-one, 1,4-dihydroxy-
CAS Number:
17623-99-3
Molecular Formula:
C13H8O4
Molecular Weight:
228.2002
IUPAC Name:
1,4-dihydroxyxanthen-9-one
InChI:
InChI=1S/C13H8O4/c14-8-5-6-9(15)13-11(8)12(16)7-3-1-2-4-10(7)17-13/h1-6,14-15H
InChI Key:
YVXJETAOWDKWOW-UHFFFAOYSA-N
SMILES:
Oc1ccc(c2c1oc1ccccc1c2=O)O
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.042g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.203g/mol
Monoisotopic Mass:
228.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| 1,4-dihydroxyxanthone modulates the adhesive property of endothelial cells by inhibiting intercellular adhesion molecule-1 (ICAM-1), vascular cell adhesion molecule-1 (VCAM-1) and E-selectin. | Bioorganic & medicinal chemistry 20040315 |
| Xanthones as inhibitors of microsomal lipid peroxidation and TNF-alpha induced ICAM-1 expression on human umbilical vein endothelial cells (HUVECs). | Bioorganic & medicinal chemistry 20021101 |
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