methyl (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

• 常用名: methyl (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
• 英文名: methyl (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
• CAS号: 17736-04-8
• 分子量: 486.72600
• 密度: N/A
• 沸点: N/A
• 分子式: C₃₁H₅₀O₄
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: methyl (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

物理化学性质

• 分子式: C₃₁H₅₀O₄
• 分子量: 486.72600
• 精确质量: 486.37100
• PSA: 66.76000
• LogP: 6.29440
• InChIKey: PLMKQQMDOMTZGG-HDUSDABTSA-N
• SMILES: COC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(O)C(C)(CO)C4CCC3(C)C1(C)CC2

英文别名

• Methyl hederagenin
• Hederagenin methyl ester
• UNII-3M463IF95D
• Olean-12-en-28-oic acid,3,23-dihydroxy-,methyl ester,(3beta,4alpha)
• Caulosapogenin,methyl ester
• Hederagenin methyl ester [MI]
• Methyl hederagenate
• Olean-12-en-28-oic acid,3beta,23-dihydroxy-,methyl ester