Account 3-((5-amino-1-(2-hydroxyethyl)-1H-pyrazol-2-ium-2-yl)methyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
- Catalog No. :
- ACLQLD335
- CAS No. :
- 122841-10-5
- Molecular Formula :
- C19H22N8O6S2
- Molecular Weight :
- 522.57
IUPAC Name:3-((5-amino-1-(2-hydroxyethyl)-1H-pyrazol-2-ium-2-yl)methyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
![3-((5-amino-1-(2-hydroxyethyl)-1H-pyrazol-2-ium-2-yl)methyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 3-((5-amino-1-(2-hydroxyethyl)-1H-pyrazol-2-ium-2-yl)methyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
|---|---|
| IUPAC Name | 3-((5-amino-1-(2-hydroxyethyl)-1H-pyrazol-2-ium-2-yl)methyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
| Molecular Formula | C19H22N8O6S2 |
| Molecular Weight | 522.57 |
| SMILES | CON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[N+]3=CC=C(N)N3CCO)CSC12)C1=CSC(N)=N1 |
| InChI Key | BHXLLRXDAYEMPP-UHFFFAOYSA-N |
| Synonym | cefoselis;(6r,7r)-7-[[(2z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[[2-(2-hydroxyethyl)-3-iminopyrazol-1-yl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2Z)-2-(2-amino-4-thiazolyl)-2-(methoxyimino)acetyl]amino]-3-[[2,3-dihydro-2-(2-hydroxyethyl)-3-imino-1H-pyrazol-1-yl]methyl]-8-oxo-, (6R,7R)-;Cefoselis USP/EP/BP |
| CAS No. | 122841-10-5 |
Synthetic Route by SureRoute
2. ACLQLD335 Molecular Building Block Synthetic Route
(6R,7R)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-3-((2-(2-hydroxyethyl)-3-imino-2,3-dihydro-1H-pyrazol-1-yl)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid--sulfuric acid (1/1)
(6R,7R)-7-((Z)-2-(2-Aminothiazol-4-yl)-2-(((2-carboxypropan-2-yl)oxy)imino)acetamido)-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (contains ca. 10% Na2CO3)
(6R,7R)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(((2-carboxypropan-2-yl)oxy)imino)acetamido)-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride