Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
포미다실린
포미다실린 · Imipenem 16 · Fomidacillin · Formidacillin · (2S,5R,6R)-6-[[(2R)-2-(3,4-dihydroxyphenyl)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]acetyl]amino]-6-formamido-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid · 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2R)-2-(3,4-dihydroxyphenyl)-2-[[(4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]acetyl]amino]-6-(formylamino)-3,3-dimethyl-7-oxo-, (2S,5R,6R)-
식별자 및 물리적 특성
| CAS No. | 98048-07-8 |
|---|---|
| 분자식 | C24H28N6O10S |
| 평균 분자량 | 592.6 g/mol |
| 단동위원소 질량 | 592.15876228 g/mol |
| SMILES | CCN1CCN(C(=O)N[C@@H](C(=O)N[C@]2(NC=O)C(=O)N3[C@@H](C(=O)O)C(C)(C)S[C@@H]32)c2ccc(O)c(O)c2)C(=O)C1=O |
| InChIKey | BLHZPPIRNRDRSC-HSDAMQNGSA-N |
| PubChem CID | 72025 |
| ChEMBL | CHEMBL2105850 |
| DTXSID | DTXSID301024779 |
| 현지명 | 포미다실린 |
화학 및 물리적 성질
| XLogP | 0.1 |
|---|---|
| 극성 표면적 | 251 |
| 수소 결합 공여자 수 | 6 |
| 수소 결합 수용자 수 | 11 |
| 회전 가능 결합 수 | 7 |
| 무거운 원자 수 | 41 |
| 형식 전하 | 0 |
| 복잡도 | 1,170 |
| 의약품 | Pharmaceuticals -> Antibiotics |
| 밀도 | 1.67±0.1 g/cm3(Predicted) |
| pKa(산도 계수) | 2.45±0.50(Predicted) |
용도
용도
Fomidacillin is β-lactamase stable Penicillin derivative with antibacterial activity comparable to Imipenem (I465200), and Ceftazidime (C244100) antibiotics. Fomidacillin is also an analogue of Piperacillin (P479950), which is a broad spectrum semi-synthetic antibiotic.