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2345-17-7 | 4H-1-Benzopyran-4-one, 5,7-dihydroxy-6-methoxy-3-(4-methoxyphenyl)-
CAS No: 2345-17-7 Catalog No: AG002NAA MDL No:
Product Description
Catalog Number:
AG002NAA
Chemical Name:
4H-1-Benzopyran-4-one, 5,7-dihydroxy-6-methoxy-3-(4-methoxyphenyl)-
CAS Number:
2345-17-7
Molecular Formula:
C17H14O6
Molecular Weight:
314.2895
IUPAC Name:
5,7-dihydroxy-6-methoxy-3-(4-methoxyphenyl)chromen-4-one
InChI:
InChI=1S/C17H14O6/c1-21-10-5-3-9(4-6-10)11-8-23-13-7-12(18)17(22-2)16(20)14(13)15(11)19/h3-8,18,20H,1-2H3
InChI Key:
VOOFPOMXNLNEOF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1coc2c(c1=O)c(O)c(c(c2)O)OC
UNII:
081ORX70ZR
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.079g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
314.293g/mol
Monoisotopic Mass:
314.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
85.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
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|---|---|
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| Cardioprotective effect of 'methylamine irisolidone', a new compound, in hypoxia/reoxygenation injury in cultured rat cardiac myocytes. | Chemistry & biodiversity 20090801 |
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| Protective effect of irisolidone, a metabolite of kakkalide, against hydrogen peroxide induced cell damage via antioxidant effect. | Bioorganic & medicinal chemistry 20080201 |
| Metabolomics reveals novel pathways and differential mechanistic and elicitor-specific responses in phenylpropanoid and isoflavonoid biosynthesis in Medicago truncatula cell cultures. | Plant physiology 20080201 |
| New isoflavones from Iris kashmiriana. | Journal of Asian natural products research 20080101 |
| Kakkalide and irisolidone: HMG-CoA reductase inhibitors isolated from the flower of Pueraria thunbergiana. | Biological & pharmaceutical bulletin 20071001 |
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| Estrogenic effect of main components kakkalide and tectoridin of Puerariae Flos and their metabolites. | Biological & pharmaceutical bulletin 20060601 |
| Irisolidone, an isoflavone metabolite, represses JC virus gene expression via inhibition of Sp1 binding in human glial cells. | Biochemical and biophysical research communications 20060526 |
| Hepatoprotective effects of irisolidone on tert-butyl hyperoxide-induced liver injury. | Biological & pharmaceutical bulletin 20050301 |
| Protective effects of kakkalide from Flos puerariae on ethanol-induced lethality and hepatic injury are dependent on its biotransformation by human intestinal microflora. | Journal of pharmacological sciences 20031101 |
| Cancer chemopreventive in vitro activities of isoflavones isolated from Iris germanica. | Planta medica 20030101 |
| A prospective cohort study of soy product intake and stomach cancer death. | British journal of cancer 20020701 |
| Effects of naturally occurring isoflavones on prostaglandin E2 production. | Planta medica 20020201 |
| Interaction of phytoestrogens with estrogen receptors alpha and beta (II). | Biological & pharmaceutical bulletin 20020101 |
| In vitro anti-Helicobacter pylori activity of irisolidone isolated from the flowers and rhizomes of Pueraria thunbergiana. | Planta medica 20010301 |
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