133538-58-6,MFCD00216083
Catalog No.:AA009AIO

133538-58-6 | I-SAP

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$822.00   $575.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA009AIO
Chemical Name:
I-SAP
CAS Number:
133538-58-6
Molecular Formula:
C22H30INO4S
Molecular Weight:
531.4474
MDL Number:
MFCD00216083
SMILES:
OC(=O)CCC/C=C\C[C@@H]1[C@H](C[C@H]2C[C@@H]1C2(C)C)NS(=O)(=O)c1ccc(cc1)I
Properties
Computed Properties
 
Complexity:
707  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
1  
Formal Charge:
0  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
9  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
5.1  

Literature

Title: 7-[(1R,2S,3S,5R)-6,6-dimethyl-3-(4- iodobenzenesulfonylamino)bicyclo[3.1.1]hept-2-yl]-5(Z)-heptenoic acid: a novel high-affinity radiolabeled antagonist for platelet thromboxane A2/prostaglandin H2 receptors.

Journal: The Journal of pharmacology and experimental therapeutics 19920801

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Tags:133538-58-6 Molecular Formula|133538-58-6 MDL|133538-58-6 SMILES|133538-58-6 I-SAP
Catalog No.: AA009AIO
133538-58-6,MFCD00216083
133538-58-6 | I-SAP
Pack Size: 1mg
Purity: ≥98%
in stock
$822.00 $575.00
Quantity
- +
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Technical Information
Catalog Number: AA009AIO
Chemical Name: I-SAP
CAS Number: 133538-58-6
Molecular Formula: C22H30INO4S
Molecular Weight: 531.4474
MDL Number: MFCD00216083
SMILES: OC(=O)CCC/C=C\C[C@@H]1[C@H](C[C@H]2C[C@@H]1C2(C)C)NS(=O)(=O)c1ccc(cc1)I
Properties
Complexity: 707  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 4  
Defined Bond Stereocenter Count: 1  
Formal Charge: 0  
Heavy Atom Count: 29  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 9  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 5.1  
Literature fold

Title: 7-[(1R,2S,3S,5R)-6,6-dimethyl-3-(4- iodobenzenesulfonylamino)bicyclo[3.1.1]hept-2-yl]-5(Z)-heptenoic acid: a novel high-affinity radiolabeled antagonist for platelet thromboxane A2/prostaglandin H2 receptors.

Journal: The Journal of pharmacology and experimental therapeutics19920801

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