5'α(S)-sec-butyl-9,10α-dihydro-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione

• 常用名: 5'α(S)-sec-butyl-9,10α-dihydro-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
• 英文名: 5'α(S)-sec-butyl-9,10α-dihydro-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione
• CAS号: 19467-62-0
• 分子量: 577.71400
• 密度: 1.36g/cm3
• 沸点: 848.4ºC at 760mmHg
• 分子式: C₃₂H₄₃N₅O₅
• 熔点: N/A
• 闪点: 466.9ºC

名称

• 英文名: β-dihydroergocryptine

物理化学性质

• 密度: 1.36g/cm3
• 沸点: 848.4ºC at 760mmHg
• 分子式: C₃₂H₄₃N₅O₅
• 分子量: 577.71400
• 闪点: 466.9ºC
• 精确质量: 577.32600
• PSA: 121.70000
• LogP: 3.17460
• InChIKey: SBFXHXZNBNFPHV-PSELOKDRSA-N
• SMILES: CCC(C)C1C(=O)N2CCCC2C2(O)OC(NC(=O)C3CC4c5cccc6[nH]cc(c56)CC4N(C)C3)(C(C)C)C(=O)N12

英文别名

• 5'-sec-butyl-12'-hydroxy-2'-isopropyl-9,10-dihydro-ergotamane-18,3',6'-trione
• EINECS 243-089-3