Account ((((2R,3S,5R)-3-(((2-((Carboxymethyl)amino)-2-oxoethyl)carbamoyl)oxy)-5-(2-isobutyramido-6-oxo-1,6-dihydro-9H-purin-9-yl)tetrahydrofuran-2-yl)methoxy)carbonyl)glycylglycine
- Catalog No. :
- ACPFJO315
- CAS No. :
- 1357928-14-3
- Molecular Formula :
- C24H31N9O13
- Molecular Weight :
- 653.56
IUPAC Name:((((2R,3S,5R)-3-(((2-((carboxymethyl)amino)-2-oxoethyl)carbamoyl)oxy)-5-(2-isobutyramido-6-oxo-1,6-dihydro-9H-purin-9-yl)tetrahydrofuran-2-yl)methoxy)carbonyl)glycylglycine
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Product Information
| Product Name | ((((2R,3S,5R)-3-(((2-((Carboxymethyl)amino)-2-oxoethyl)carbamoyl)oxy)-5-(2-isobutyramido-6-oxo-1,6-dihydro-9H-purin-9-yl)tetrahydrofuran-2-yl)methoxy)carbonyl)glycylglycine |
|---|---|
| IUPAC Name | ((((2R,3S,5R)-3-(((2-((carboxymethyl)amino)-2-oxoethyl)carbamoyl)oxy)-5-(2-isobutyramido-6-oxo-1,6-dihydro-9H-purin-9-yl)tetrahydrofuran-2-yl)methoxy)carbonyl)glycylglycine |
| MDL No. | MFCD26961072 |
| Molecular Formula | C24H31N9O13 |
| Molecular Weight | 653.56 |
| SMILES | O=C(CNC(CNC(OC[C@H]1O[C@H](C[C@@H]1OC(NCC(NCC(O)=O)=O)=O)N2C=NC3=C2N=C(NC3=O)NC(C(C)C)=O)=O)=O)O |
| InChI Key | KREXTMSNGTWUJT-YWPYICTPSA-N |
| Synonym | 2-(2-((((2R,3S,5R)-3-(2-(carboxymethylamino)-2-oxoethylcarbamoyloxy)-5-(2-isobutyramido-6-oxo-1H-purin-9(6H)-yl)tetrahydrofuran-2-yl)methoxy)carbonylamino)acetamido)acetic acid;RELACIN;Glycine, N-carboxyglycyl-, (1→3'),(1'→5')-diester with 2-deoxy-N-(2-methyl-1-oxopropyl)guanosine |
| CAS No. | 1357928-14-3 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACPFJO315 Molecular Building Block Synthetic Route
3’-O-Acetyl-N2-iso-Butyroyl-2’-deoxy-guanosine
(2R,3S,5R)-2-(Hydroxymethyl)-5-(2-isobutyramido-6-oxo-1,6-dihydro-9H-purin-9-yl)tetrahydrofuran-3-yl 4-oxopentanoate
((2R,3S,5R)-3-Hydroxy-5-(2-isobutyramido-6-oxo-3H-purin-9(6H)-yl)tetrahydrofuran-2-yl)methyl 4-oxopentanoate