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Home > Other Building Blocks > 126432-36-8
126432-36-8 | 4H-1-Benzopyran-4-one, 2-(3,4,5-trihydroxyphenyl)-
CAS No: 126432-36-8 Catalog No: AG000SSO MDL No:MFCD18450872
Product Description
Catalog Number:
AG000SSO
Chemical Name:
4H-1-Benzopyran-4-one, 2-(3,4,5-trihydroxyphenyl)-
CAS Number:
126432-36-8
Molecular Formula:
C15H10O5
Molecular Weight:
270.2369
MDL Number:
MFCD18450872
IUPAC Name:
2-(3,4,5-trihydroxyphenyl)chromen-4-one
InChI:
InChI=1S/C15H10O5/c16-10-7-14(20-13-4-2-1-3-9(10)13)8-5-11(17)15(19)12(18)6-8/h1-7,17-19H
InChI Key:
YKIGTAPSUMVDNX-UHFFFAOYSA-N
SMILES:
Oc1c(O)cc(cc1O)c1cc(=O)c2c(o1)cccc2
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.053g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
270.24g/mol
Monoisotopic Mass:
270.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| 3,3',4',5,5'-Pentahydroxyflavone is a potent inhibitor of amyloid β fibril formation. | Neuroscience letters 20120328 |
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