compound introduction
西罗辛平是一种育亨宾生物碱。
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Daily chemical industry
methyl (1R,15S,17R,18R,19S,20S)-17-(4-ethoxycarbonyloxy-3,5-dimethoxybenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
CAS number：84-36-6 molecular formula：C35H42N2O11
overview
Specs
| Chinese alias | 昔洛舍平 (Su-3118) | ||
| English alias | Londomin | Prestwick_457 | Syrosingopine (JAN/INN) | Yohimban-16-carboxylic acid,5-dimethoxybenzoyl]oxy]-11,17-dimethoxy-, methyl ester, (3.beta.,16.beta.,17.alpha.,18.beta.,20.alpha.)- | DTXSID9023629 | Syringic acid ethyl carbonate ester with methyl res | ||
| CAS number | 84-36-6 | molecular formula | C35H42N2O11 |
| molecular weight | 666.7 | Exact mass | ≥98% |
| PSA | 144 | logp | 4.6 |
numbering system
| CAS | 84-36-6 |
| UNII | PPG46JF0EG |
| KEGG ID | D01659 |
| ChEBI ID | 32175 |
| Wikidata | Q27164011 |
| ChEMBL ID | CHEMBL1399124 |
| Wikipedia | Syrosingopine |
| NSC Number | NSC Number: NSC77030 |
| DrugBank ID | DB19379 |
| DrugCentral | 2550 |
| PubChem CID | 6769 |
| Nikkaji Number | J3.879B |
| NCI 词表代码 | C152485 |
| DSSTox Substance ID | DTXSID9023629 |
| European Community (EC) Number | 201-527-0 |
| PubChem Reference Collection SID | 516578378 |
| International Nonproprietary Names (INN) | SYROSINGOPINE |
physicochemical properties
| XLogP3 | XLogP3-AA: 4.6 |
| 复杂性 | 1130 |
| Exact Mass | 666.27886016 |
| 形式电荷 | 0 |
| 重原子计数 | 48 |
| Molecular Weight | 666.7 |
| Monoisotopic Mass | 666.27886016 |
| 可旋转键计数 | 13 |
| 氢键供体计数 | 1 |
| 氢键受体计数 | 12 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 144 Ų |
| 定义键立体中心计数 | 0 |
| 定义原子立体中心计数 | 6 |
| 未定义键立体中心计数 | 0 |
| 未定义原子手性中心计数 | 0 |
Safety information
No safety information yet
Production methods and uses
purpose
工业应用参考：
工业分类参考：非金属矿物制品业。
应用场景参考：常见于生产制造场景，可作为主料、辅料、添加剂或工艺辅助材料参与配方与加工流程 。
作用参考：在电池、电子、信息材料和高端制造等技术方向，常被视为可拓展的功能材料或中间材料 。
选型提示：涉及安全应用管理时，仍应以 MSDS、产品详情页和现场工艺控制要求为准，不应由参考文案替代 。
Related
upstream information
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downstream information
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MSDS
Found 0 shareMSDS
