Account (S)-2-(((2S,6R)-4-(Carboxymethyl)-5-oxo-2-(thiophen-2-yl)-1,4-thiazepan-6-yl)amino)-4-phenylbutanoic acid
- Catalog No. :
- ACCXUG793
- CAS No. :
- 110221-53-9
- Molecular Formula :
- C21H24N2O5S2
- Molecular Weight :
- 448.57
IUPAC Name:(S)-2-(((2S,6R)-4-(carboxymethyl)-5-oxo-2-(thiophen-2-yl)-1,4-thiazepan-6-yl)amino)-4-phenylbutanoic acid
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Product Information
| Product Name | (S)-2-(((2S,6R)-4-(Carboxymethyl)-5-oxo-2-(thiophen-2-yl)-1,4-thiazepan-6-yl)amino)-4-phenylbutanoic acid |
|---|---|
| IUPAC Name | (S)-2-(((2S,6R)-4-(carboxymethyl)-5-oxo-2-(thiophen-2-yl)-1,4-thiazepan-6-yl)amino)-4-phenylbutanoic acid |
| Molecular Formula | C21H24N2O5S2 |
| Molecular Weight | 448.57 |
| SMILES | O=C(O)[C@@H](N[C@@H]1C(N(CC(O)=O)C[C@@H](C2=CC=CS2)SC1)=O)CCC3=CC=CC=C3 |
| InChI Key | KZVWEOXAPZXAFB-BQFCYCMXSA-N |
| Synonym | GTPL11737 | GTPL3879 | UNII-2D6A12Q12R | HY-A0117 | (2S)-2-[[(2S,6R)-4-(carboxymethyl)-5-oxo-2-thiophen-2-yl-1,4-thiazepan-6-yl]amino]-4-phenylbutanoic acid | RNH5139 | RNH-5139 | Q27108393 | BDBM50024710 | 2-(4-Carboxymethyl-5-oxo-2-thiophen-2-yl-[1,4]th |
| CAS No. | 110221-53-9 |
| PubChem CID | 443151 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H317-H319
- Precautionary Statement(s)
- P280-P305+P351+P338
Synthetic Route by SureRoute
2. ACCXUG793 Molecular Building Block Synthetic Route
2-((2S,6R)-6-(((S)-1-Ethoxy-1-oxo-4-phenylbutan-2-yl)amino)-5-oxo-2-(thiophen-2-yl)-1,4-thiazepan-4-yl)acetic acid hydrochloride
2-((2S,6R)-6-(((S)-1-Ethoxy-1-oxo-4-phenylbutan-2-yl)amino)-5-oxo-2-(thiophen-2-yl)-1,4-thiazepan-4-yl)acetic acid