Account β-FXR antagonist 1
- Catalog No. :
- ACVRII358
- CAS No. :
- 2295804-92-9
- Molecular Formula :
- C36H59NO5
- Molecular Weight :
- 585.87
IUPAC Name:((1S,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(butyryloxy)-1-isopropyl-5a,5b,8,8,11a-pentamethylicosahydro-1H-cyclopenta[a]chrysene-3a-carbonyl)glycine
Pack SizePurityList PriceYour PriceGlobal StockUS StockQuantity
1mg95%$237.00Login to see priceInquiryInquiry
5mg95%$588.00Login to see priceInquiryInquiry
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Product Information
| Product Name | β-FXR antagonist 1 |
|---|---|
| IUPAC Name | ((1S,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(butyryloxy)-1-isopropyl-5a,5b,8,8,11a-pentamethylicosahydro-1H-cyclopenta[a]chrysene-3a-carbonyl)glycine |
| Molecular Formula | C36H59NO5 |
| Molecular Weight | 585.87 |
| SMILES | C(NCC(O)=O)(=O)[C@]12[C@@]([C@@]3([C@@](C)(CC1)[C@@]4(C)[C@](CC3)([C@]5(C)[C@@](CC4)(C(C)(C)[C@@H](OC(CCC)=O)CC5)[H])[H])[H])([C@H]([C@H](C)C)CC2)[H] |
| InChI Key | CLKCLHBPLVDIOB-WYNSFBPCSA-N |
| Synonym | β-FXR antagonist 1;Glycine, N-[(3β)-28-oxo-3-(1-oxobutoxy)lupan-28-yl]- |
| CAS No. | 2295804-92-9 |
Synthetic Route by SureRoute
2. ACVRII358 Molecular Building Block Synthetic Route
Methyl 4-(ethylcarbamoyl)cubane-1-carboxylate
Ethyl Glycodeoxycholate
ethyl ((R)-4-((3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoyl)glycinate