Account (2R,6S,13aS,14aR,16aS,E)-6-((tert-butoxycarbonyl)amino)-2-hydroxy-5,16-dioxo-1,2,3,6,7,8,9,10,11,13a,14,15,16,16a-tetradecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecine-14a(5H)-carboxylic acid trihydrate
- Catalog No. :
- ACQFPU284
- CAS No. :
- 552335-46-3
- Molecular Formula :
- C23H41N3O10
- Molecular Weight :
- 519.59
IUPAC Name:(2R,6S,13aS,14aR,16aS,E)-6-((tert-butoxycarbonyl)amino)-2-hydroxy-5,16-dioxo-1,2,3,6,7,8,9,10,11,13a,14,15,16,16a-tetradecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecine-14a(5H)-carboxylic acid trihydrate
![(2R,6S,13aS,14aR,16aS,E)-6-((tert-butoxycarbonyl)amino)-2-hydroxy-5,16-dioxo-1,2,3,6,7,8,9,10,11,13a,14,15,16,16a-tetradecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecine-14a(5H)-carboxylic acid trihydrate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (2R,6S,13aS,14aR,16aS,E)-6-((tert-butoxycarbonyl)amino)-2-hydroxy-5,16-dioxo-1,2,3,6,7,8,9,10,11,13a,14,15,16,16a-tetradecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecine-14a(5H)-carboxylic acid trihydrate |
|---|---|
| IUPAC Name | (2R,6S,13aS,14aR,16aS,E)-6-((tert-butoxycarbonyl)amino)-2-hydroxy-5,16-dioxo-1,2,3,6,7,8,9,10,11,13a,14,15,16,16a-tetradecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecine-14a(5H)-carboxylic acid trihydrate |
| Molecular Formula | C23H41N3O10 |
| Molecular Weight | 519.59 |
| SMILES | O=C([C@]([C@]1([H])/C=C/CCCCC[C@@H]2NC(OC(C)(C)C)=O)(C1)NC([C@@](C[C@@H](O)C3)([H])N3C2=O)=O)O.[H]O[H].[H]O[H].[H]O[H] |
| InChI Key | HJOOPZKYGURZJS-QALMSVHJSA-N |
| Synonym | Cyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecine-14a(5H)-carboxylic acid, 6-[[(1,1-dimethylethoxy)carbonyl]amino]-1,2,3,6,7,8,9,10,11,13a,14,15,16,16a-tetradecahydro-2-hydroxy-5,16-dioxo-, (2R,6S,12Z,13aS,14aR,16aS)- |
| CAS No. | 552335-46-3 |
Synthetic Route by SureRoute
2. ACQFPU284 Molecular Building Block Synthetic Route
Methyl (2R,6S,13aS,14aR,16aS,Z)-6-((tert-butoxycarbonyl)amino)-2-hydroxy-5,16-dioxo-1,2,3,6,7,8,9,10,11,13a,14,15,16,16a-tetradecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecine-14a(5H)-carboxylate
tert-Butyl ((2R,6S,13aS,14aR,16aS,Z)-14a-((cyclopropylsulfonyl)carbamoyl)-2-hydroxy-5,16-dioxo-1,2,3,5,6,7,8,9,10,11,13a,14,14a,15,16,16a-hexadecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecin-6-yl)carbamate
methyl (6S,10aR,Z)-6-((tert-butoxycarbonyl)amino)-5-oxo-2,3,5,6,7,10-hexahydropyrrolo[1,2-a]azocine-10a(1H)-carboxylate