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Home Other Building Blocks 146698-96-6
146698-96-6,MFCD03425562
Catalog No.:AA001E5C

146698-96-6 | 4H-1-Benzopyran-4-one, 7-ethoxy-3-(4-hydroxyphenyl)-

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Purity
Availability
Price(USD)
Quantity
  
10mg
2 weeks  
$1,919.00   $1,343.00
- +
50mg
2 weeks  
$4,143.00   $2,900.00
- +
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA001E5C
Chemical Name:
4H-1-Benzopyran-4-one, 7-ethoxy-3-(4-hydroxyphenyl)-
CAS Number:
146698-96-6
Molecular Formula:
C17H14O4
Molecular Weight:
282.2907
MDL Number:
MFCD03425562
SMILES:
CCOc1ccc2c(c1)occ(c2=O)c1ccc(cc1)O
Properties
Computed Properties
 
Complexity:
409  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
3.2  

Literature

Title: Effects of 7-O substitutions on estrogenic and anti-estrogenic activities of daidzein analogues in MCF-7 breast cancer cells.

Journal: Journal of medicinal chemistry 20100826

Title: Structure of daidzin, a naturally occurring anti-alcohol-addiction agent, in complex with human mitochondrial aldehyde dehydrogenase.

Journal: Journal of medicinal chemistry 20080814

Title: Synthesis of potential antidipsotropic isoflavones: inhibitors of the mitochondrial monoamine oxidase-aldehyde dehydrogenase pathway.

Journal: Journal of medicinal chemistry 20010927

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SDS
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Tags:146698-96-6 Molecular Formula|146698-96-6 MDL|146698-96-6 SMILES|146698-96-6 4H-1-Benzopyran-4-one, 7-ethoxy-3-(4-hydroxyphenyl)-