Account Colibactin 742
- Catalog No. :
- ACYGBS223
- CAS No. :
- 2916559-62-9
- Molecular Formula :
- C37H42N8O5S2
- Molecular Weight :
- 742.93
IUPAC Name:N-((4-(2-(4-(3-hydroxy-4-(6-((S)-2-methyl-3,4-dihydro-2H-pyrrol-5-yl)-5-oxo-4-azaspiro[2.4]hept-6-en-7-yl)-5-oxopyrrolidin-3-yl)thiazol-2-yl)ethyl)thiazol-2-yl)methyl)-2-(6-((S)-2-methyl-3,4-dihydro-2H-pyrrol-5-yl)-5-oxo-4-azaspiro[2.4]hept-6-en-7-yl)acetamide
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Product Information
| Product Name | Colibactin 742 |
|---|---|
| IUPAC Name | N-((4-(2-(4-(3-hydroxy-4-(6-((S)-2-methyl-3,4-dihydro-2H-pyrrol-5-yl)-5-oxo-4-azaspiro[2.4]hept-6-en-7-yl)-5-oxopyrrolidin-3-yl)thiazol-2-yl)ethyl)thiazol-2-yl)methyl)-2-(6-((S)-2-methyl-3,4-dihydro-2H-pyrrol-5-yl)-5-oxo-4-azaspiro[2.4]hept-6-en-7-yl)acetamide |
| Molecular Formula | C37H42N8O5S2 |
| Molecular Weight | 742.93 |
| SMILES | O=C(NCC1=NC(CCC2=NC(C(C3C(C4(N5)CC4)=C(C6=N[C@@H](C)CC6)C5=O)(O)CNC3=O)=CS2)=CS1)CC(C7(N8)CC7)=C(C9=N[C@@H](C)CC9)C8=O |
| InChI Key | MUFRDBRHJIYYPD-AYLSQICOSA-N |
| Synonym | 4-Azaspiro[2.4]hept-6-ene-7-acetamide, 6-[(2S)-3,4-dihydro-2-methyl-2H-pyrrol-5-yl]-N-[[4-[2-[4-[4-[6-[(2S)-3,4-dihydro-2-methyl-2H-pyrrol-5-yl]-5-oxo-4-azaspiro[2.4]hept-6-en-7-yl]-3-hydroxy-5-oxo-3-pyrrolidinyl]-2-thiazolyl]ethyl]-2-thiazolyl]methyl]-5-oxo-;Colibactin 742 |
| CAS No. | 2916559-62-9 |
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