![1-[[(6R,7R)-7-[[(2Z)-2-(2-AMino-4-thiazolyl)-2-[[2-(1,1-diMethylethoxy)-1,1-diMethyl-2-oxoethoxy]iMino]acetyl]aMino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]Methyl]pyridiniuM Inner Salt structure, CAS 102772-66-7](/structures/210000/181458_1_102772_66_7.png)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 102772-66-7 |
| Catalog No. | 2A-3180592 |
| Chinese Name | 头孢他啶叔丁酯 |
| Synonyms | Exact Mass 602.161743; PSA 237.98000; LogP -1.15; InChIKey KRTGQDGIPNXUGP-ZLQBWVSZSA-N |
| Molecular Formula | C26H30N6O7S2 |
| Molecular Weight | 546.58 (anhydrous basis) |
| Appearance | solid |
| Storage Condition | -20°C |
| PubChem ID | 329770910 |
| SMILES | CC(C)(C)OC(=O)C(C)(C)ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1 |
| InChI | InChI=1S/C26H30N6O7S2/c1-25(2,3)38-23(37)26(4,5)39-30-16(15-13-41-24(27)28-15)19(33)29-17-20(34)32-18(22(35)36)14(12-40-21(17)32)11-31-9-7-6-8-10-31/h6-10,13,17,21H,11-12H2,1-5H3,(H3-,27,28,29,33,35,36)/b30-16-/t17-,21-/m1/s1 |
| InChI Key | KRTGQDGIPNXUGP-ZLQBWVSZSA-N |
| Transport Info | Product name: Ceftazidime tert-butyl ester |
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