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1198786-98-9,MFCD30536210
Catalog No.:AA01EOJX

1198786-98-9 | INT-777 R-enantiomer

Pack Size
Purity
Availability
Price(USD)
Quantity
  
2mg
98%
1 week  
$717.00   $502.00
- +
5mg
98%
1 week  
$1,384.00   $969.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01EOJX
Chemical Name:
INT-777 R-enantiomer
CAS Number:
1198786-98-9
Molecular Formula:
C27H46O5
Molecular Weight:
450.6511
MDL Number:
MFCD30536210
SMILES:
CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)[C@H](C[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)O)[C@@H](C[C@H](C(=O)O)C)C
Properties
Computed Properties
 
Complexity:
710  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
6  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
7  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.9  

Literature

Title: Pellicciari R, et al. Discovery of 6alpha-ethyl-23(S)-methylcholic acid (S-EMCA, INT-777) as a potent and selective agonist for the TGR5 receptor, a novel target for diabesity. J Med Chem. 2009 Dec 24;52(24):7958-61.

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SDS
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Tags:1198786-98-9 Molecular Formula|1198786-98-9 MDL|1198786-98-9 SMILES|1198786-98-9 INT-777 R-enantiomer
Catalog No.: AA01EOJX
1198786-98-9,MFCD30536210
1198786-98-9 | INT-777 R-enantiomer
Pack Size： 2mg
Purity： 98%
1 week
$717.00 $502.00
Pack Size： 5mg
Purity： 98%
1 week
$1,384.00 $969.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01EOJX
Chemical Name: INT-777 R-enantiomer
CAS Number: 1198786-98-9
Molecular Formula: C27H46O5
Molecular Weight: 450.6511
MDL Number: MFCD30536210
SMILES: CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)[C@H](C[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)O)[C@@H](C[C@H](C(=O)O)C)C
Properties
Complexity: 710  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 6  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 32  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 4  
Isotope Atom Count: 0  
Rotatable Bond Count: 5  
Undefined Atom Stereocenter Count: 7  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.9  
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