Account (3R,5R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-5-(dioctylamino)-5-oxopentan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diyl bis(4-(2,2,2-trifluoroacetyl)benzoate)
- Catalog No. :
- ACJQKP477
- CAS No. :
- 222310-82-9
- Molecular Formula :
- C58H79F6NO7
- Molecular Weight :
- 1016.26
IUPAC Name:(3R,5R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-5-(dioctylamino)-5-oxopentan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diyl bis(4-(2,2,2-trifluoroacetyl)benzoate)
![(3R,5R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-5-(dioctylamino)-5-oxopentan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diyl bis(4-(2,2,2-trifluoroacetyl)benzoate) structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (3R,5R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-5-(dioctylamino)-5-oxopentan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diyl bis(4-(2,2,2-trifluoroacetyl)benzoate) |
|---|---|
| IUPAC Name | (3R,5R,8R,9S,10S,12S,13R,14S,17R)-17-((R)-5-(dioctylamino)-5-oxopentan-2-yl)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-3,12-diyl bis(4-(2,2,2-trifluoroacetyl)benzoate) |
| Molecular Formula | C58H79F6NO7 |
| Molecular Weight | 1016.26 |
| SMILES | CCCCCCCCN(CCCCCCCC)C(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(=O)C5=CC=C(C(=O)C(F)(F)F)C=C5)CC[C@]4(C)[C@H]3C[C@H](OC(=O)C3=CC=C(C(=O)C(F)(F)F)C=C3)[C@]12C |
| InChI Key | PNOQSKXIBWVYCX-PNZPGYLPSA-N |
| Synonym | N,N-Dioctyl-3α,12α-bis(4-trifluoroacetylbenzoyloxy)-5β-cholan-24-amide |
| CAS No. | 222310-82-9 |
| PubChem CID | 99649076 |
Synthetic Route by SureRoute
2. ACJQKP477 Molecular Building Block Synthetic Route
3-((Diethylamino)methyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl benzoate hydrochloride
(1R,2R,4S)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-yl 4-(cyanomethyl)benzoate
1,7,7-Trimethyl-3-(pyrrolidin-1-ylmethyl)bicyclo[2.2.1]heptan-2-yl 4-aminobenzoate