2'-ethyl-12'-hydroxy-5'-isopropyl-9,10-dihydro-ergotamane-18,3',6'-trione结构式
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常用名 | 2'-ethyl-12'-hydroxy-5'-isopropyl-9,10-dihydro-ergotamane-18,3',6'-trione | 英文名 | 2'-ethyl-12'-hydroxy-5'-isopropyl-9,10-dihydro-ergotamane-18,3',6'-trione |
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| CAS号 | 35167-84-1 | 分子量 | 549.66100 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C30H39N5O5 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 英文名 | 2'-ethyl-12'-hydroxy-5'-isopropyl-9,10-dihydro-ergotamane-18,3',6'-trione |
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| 英文别名 | 更多 |
| 分子式 | C30H39N5O5 |
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| 分子量 | 549.66100 |
| 精确质量 | 549.29500 |
| PSA | 118.21000 |
| LogP | 2.08910 |
| InChIKey | QKMRPKVJXKAXHL-OLNIQZLRSA-N |
| SMILES | CCC1(NC(=O)C2CC3c4cccc5[nH]cc(c45)CC3N(C)C2)OC2(O)C3CCCN3C(=O)C(C(C)C)N2C1=O |
| Ergotaman-3',6',18-trione,2'-ethyl-9,10-dihydro-12'-hydroxy-5'-(1-methylethyl)-, (5'a,10a)- |