Account (4R,5R,6aR,7aR,9R,10R,10aS,11aS,12S)-9-(6-Benzamido-9H-purin-9-yl)-2-oxooctahydro-4,11a,5-(epimethanetriyloxymethano)furo[2',3':5,6]pyrano[2,3-d][1,3,6]trioxocin-10-yl acetate
- Catalog No. :
- ACOAQF269
- CAS No. :
- 176096-03-0
- Molecular Formula :
- C26H23N5O10
- Molecular Weight :
- 565.49
IUPAC Name:(4R,5R,6aR,7aR,9R,10R,10aS,11aS,12S)-9-(6-benzamido-9H-purin-9-yl)-2-oxooctahydro-4,11a,5-(epimethanetriyloxymethano)furo[2',3':5,6]pyrano[2,3-d][1,3,6]trioxocin-10-yl acetate
![(4R,5R,6aR,7aR,9R,10R,10aS,11aS,12S)-9-(6-Benzamido-9H-purin-9-yl)-2-oxooctahydro-4,11a,5-(epimethanetriyloxymethano)furo[2',3':5,6]pyrano[2,3-d][1,3,6]trioxocin-10-yl acetate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (4R,5R,6aR,7aR,9R,10R,10aS,11aS,12S)-9-(6-Benzamido-9H-purin-9-yl)-2-oxooctahydro-4,11a,5-(epimethanetriyloxymethano)furo[2',3':5,6]pyrano[2,3-d][1,3,6]trioxocin-10-yl acetate |
|---|---|
| IUPAC Name | (4R,5R,6aR,7aR,9R,10R,10aS,11aS,12S)-9-(6-benzamido-9H-purin-9-yl)-2-oxooctahydro-4,11a,5-(epimethanetriyloxymethano)furo[2',3':5,6]pyrano[2,3-d][1,3,6]trioxocin-10-yl acetate |
| Molecular Formula | C26H23N5O10 |
| Molecular Weight | 565.49 |
| SMILES | O=C1O[C@]23[C@@]4([C@@]([C@](O[C@@]2(C[C@@]5([C@](O3)([C@@H](OC(C)=O)[C@@H](O5)N6C=7C(N=C6)=C(NC(=O)C8=CC=CC=C8)N=CN7)[H])[H])[H])(CO4)[H])(O1)[H])[H] |
| InChI Key | FFROPSGRCIRWEK-DZHTWKAUSA-N |
| Synonym | Benzamide, N-[9-[(7S)-2-O-acetyl-6,10:8,11-dianhydro-7,9-O-carbonyl-5-deoxy-D-arabino-α-L-ido-undecofuranos-7-ulo-7,3-pyranos-1-yl]-9H-purin-6-yl]- (9CI);Benzamide, N-[9-[(7S)-2-O-acetyl-6,10:8,11-dianhydro-7,9-O-carbonyl-5-deoxy-D-arabino-α-L-ido-undecofuranos-7-ulo-7,3-pyranos-1-yl]-9H-purin-6-yl]- |
| CAS No. | 176096-03-0 |
Synthetic Route by SureRoute
2. ACOAQF269 Molecular Building Block Synthetic Route
(2R,3R,4R,5R)-2-(6-Benzamido-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diyl diacetate
N-(9-((2R,3S,4S,5R)-3-Hydroxy-4-((tetrahydro-2H-pyran-2-yl)oxy)-5-(((tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydrofuran-2-yl)-9H-purin-6-yl)benzamide
(2R,3R,4R,5R)-2-(6-Benzamido-9H-purin-9-yl)-4-hydroxy-5-((phosphonooxy)methyl)tetrahydrofuran-3-yl acetate