Account rel-2-Amino-9-((1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-3,9-dihydro-6H-purin-6-one-4,6-13C2-7-15N
- Catalog No. :
- ACEHIE562
- CAS No. :
- 1329796-53-3
- Molecular Formula :
- C12H15N5O3
- Molecular Weight :
- 280.26
IUPAC Name:2-amino-9-((1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-3,9-dihydro-6H-purin-6-one-4,6-13C2-7-15N
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Product Information
| Product Name | rel-2-Amino-9-((1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-3,9-dihydro-6H-purin-6-one-4,6-13C2-7-15N |
|---|---|
| IUPAC Name | 2-amino-9-((1S,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-3,9-dihydro-6H-purin-6-one-4,6-13C2-7-15N |
| Molecular Formula | C12H15N5O3 |
| Molecular Weight | 280.26 |
| SMILES | C=C1[C@H](CO)[C@H](O)C[C@@H]1N1C=[15N]C2=[13C]1NC(N)=N[13C]2=O |
| InChI Key | QDGZDCVAUDNJFG-PUSDEWLCSA-N |
| Synonym | Entecavir-13C2,15N;2-AMino-9-[4-hydroxy-3-(hydroxyMethyl)-2-Methylidenecyclopentyl]-3H-purin-6-one-13C2,15N;Baraclude-13C2,15N;BMS 200475-13C2,15N;SQ 34676-13C2,15N |
| CAS No. | 1329796-53-3 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Synthetic Route by SureRoute
2. ACEHIE562 Molecular Building Block Synthetic Route
2-Amino-9-((1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-1,9-dihydro-6H-purin-6-one hydrate
2-Amino-9-((1R,3S,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-1H-purin-6(9H)-one
2-amino-9-((1R,3R,4R)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl)-1,9-dihydro-6H-purin-6-one