compound introduction
铜绿假单胞菌中已有报道吡咯嗪,有数据可用。
CAS number:85-66-5 molecular formula:C13H10N2O
铜绿假单胞菌中已有报道吡咯嗪,有数据可用。
| Chinese alias | 5-甲基-1(5H)-吩嗪酮 | 绿脓菌素 | ||
| English alias | 5-methylphenazin-1-one | 5-methylphenazin-1(5H)-one | 5-methyl-1,5-dihydrophenazin-1-one | Pyocyanin | PYOCYANINE | Pyrocyanine | 5-methylphenazin-5-ium-1-olate | Pyocyanin; Pyrocyanine; Sanasin; Sanazin | Sanasin | ||
| CAS number | 85-66-5 | molecular formula | C13H10N2O |
| molecular weight | 210.23 | Exact mass | - |
| PSA | 32.7 | logp | 2 |
| CAS | 85-66-5 |
| UNII | 9OQM399341 |
| HMDB ID | HMDB0256934 |
| KEGG ID | C01748 |
| Wikidata | Q410503 |
| ChEMBL ID | CHEMBL2289232 |
| Wikipedia | Pyocyanin |
| NSC Number | NSC Number: NSC400612 |
| PubChem CID | 6817 |
| Nikkaji Number | J11.662I |
| DSSTox Substance ID | DTXSID9041108 |
| Metabolomics Workbench ID | 67039 |
| European Community (EC) Number | 687-347-7 |
| PubChem Reference Collection SID | 505866318 |
| XLogP3 | XLogP3-AA: 2 |
| 复杂性 | 420 |
| Exact Mass | 210.079312947 |
| 形式电荷 | 0 |
| 解离常数 | iupacpka |
| 重原子计数 | 16 |
| Molecular Weight | 210.23 |
| Monoisotopic Mass | 210.079312947 |
| 可旋转键计数 | 0 |
| 氢键供体计数 | 0 |
| 氢键受体计数 | 3 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 32.7 Ų |
| 定义键立体中心计数 | 0 |
| 定义原子立体中心计数 | 0 |
| 未定义键立体中心计数 | 0 |
| 未定义原子手性中心计数 | 0 |
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