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38339-06-9,MFCD09840684
Catalog No.:AA0079YY

38339-06-9 | Benzeneacetic acid,3-methoxy-4-(sulfooxy)-

This product is typically in stock,please click "Inquire" below or
contact us at [email protected] for pricing and availability information.
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0079YY
Chemical Name:
Benzeneacetic acid,3-methoxy-4-(sulfooxy)-
CAS Number:
38339-06-9
Molecular Formula:
C9H10O7S
Molecular Weight:
262.2365
MDL Number:
MFCD09840684
SMILES:
COc1cc(ccc1OS(=O)(=O)O)CC(=O)O
Properties
Computed Properties
 
Complexity:
358  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
5  

Literature

Title: Metabonomics of acute kidney injury in children after cardiac surgery.

Journal: Pediatric nephrology (Berlin, Germany) 20080601

Title: Presence of virgin olive oil phenolic metabolites in human low density lipoprotein fraction: determination by high-performance liquid chromatography-electrospray ionization tandem mass spectrometry.

Journal: Analytica chimica acta 20070205

Title: Rapid high-performance liquid chromatography-electrospray ionization tandem mass spectrometry method for qualitative and quantitative analysis of virgin olive oil phenolic metabolites in human low-density lipoproteins.

Journal: Journal of chromatography. A 20060526

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Tags:38339-06-9 Molecular Formula|38339-06-9 MDL|38339-06-9 SMILES|38339-06-9 Benzeneacetic acid,3-methoxy-4-(sulfooxy)-
Catalog No.: AA0079YY
38339-06-9,MFCD09840684
38339-06-9 | Benzeneacetic acid,3-methoxy-4-(sulfooxy)-
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA0079YY
Chemical Name: Benzeneacetic acid,3-methoxy-4-(sulfooxy)-
CAS Number: 38339-06-9
Molecular Formula: C9H10O7S
Molecular Weight: 262.2365
MDL Number: MFCD09840684
SMILES: COc1cc(ccc1OS(=O)(=O)O)CC(=O)O
Properties
Complexity: 358  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 7  
Hydrogen Bond Donor Count: 2  
Rotatable Bond Count: 5  
Literature fold

Title: Metabonomics of acute kidney injury in children after cardiac surgery.

Journal: Pediatric nephrology (Berlin, Germany)20080601

Title: Presence of virgin olive oil phenolic metabolites in human low density lipoprotein fraction: determination by high-performance liquid chromatography-electrospray ionization tandem mass spectrometry.

Journal: Analytica chimica acta20070205

Title: Rapid high-performance liquid chromatography-electrospray ionization tandem mass spectrometry method for qualitative and quantitative analysis of virgin olive oil phenolic metabolites in human low-density lipoproteins.

Journal: Journal of chromatography. A20060526

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