(5'α,10α)-6-DeMethyl-9,10-dihydro-12'-hydroxy-2'-Methyl-5'-(phenylmethyl)ergotaman-3',6',18-trione

• 常用名: (5'α,10α)-6-DeMethyl-9,10-dihydro-12'-hydroxy-2'-Methyl-5'-(phenylmethyl)ergotaman-3',6',18-trione
• 英文名: (5'α,10α)-6-DeMethyl-9,10-dihydro-12'-hydroxy-2'-Methyl-5'-(phenylmethyl)ergotaman-3',6',18-trione
• CAS号: 57123-71-4
• 分子量: 569.65100
• 密度: N/A
• 沸点: N/A
• 分子式: C₃₂H₃₅N₅O₅
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: 6-demethyl-9,10-dihydroergotamine

物理化学性质

• 分子式: C₃₂H₃₅N₅O₅
• 分子量: 569.65100
• 精确质量: 569.26400
• PSA: 127.00000
• LogP: 2.33440
• InChIKey: RUDMYNQFUFZHMD-VTIMJTGVSA-N
• SMILES: CC1(NC(=O)C2CNC3Cc4c[nH]c5cccc(c45)C3C2)OC2(O)C3CCCN3C(=O)C(Cc3ccccc3)N2C1=O

英文别名

• (5'Alpha,10Alpha)-6-Demethyl-9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)ergotaman-3',6',18-trione