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Home > Other Building Blocks > 849245-33-6
849245-33-6 | 2,4,6-Heptatrien-1-one, 1,7-bis(4-hydroxyphenyl)-, (2E,4E,6E)-
CAS No: 849245-33-6 Catalog No: AG004VC4 MDL No:
Product Description
Catalog Number:
AG004VC4
Chemical Name:
2,4,6-Heptatrien-1-one, 1,7-bis(4-hydroxyphenyl)-, (2E,4E,6E)-
CAS Number:
849245-33-6
Molecular Formula:
C19H16O3
Molecular Weight:
292.3285
IUPAC Name:
1,7-bis(4-hydroxyphenyl)hepta-2,4,6-trien-1-one
InChI:
InChI=1S/C19H16O3/c20-17-11-7-15(8-12-17)5-3-1-2-4-6-19(22)16-9-13-18(21)14-10-16/h1-14,20-21H
InChI Key:
WRCGSWXFJPRBPO-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)/C=C/C=C/C=C/C(=O)c1ccc(cc1)O
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.11g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
292.334g/mol
Monoisotopic Mass:
292.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
XLogP3:
4.3
Literature
| Title | Journal |
|---|---|
| Antioxidative constituents of Etlingera elatior. | Journal of natural products 20050201 |
| Antitumour-promoting and cytotoxic constituents of etlingera elatior. | The Malaysian journal of medical sciences : MJMS 20050101 |
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