5594-30-9

5594-30-9结构式

中文名	脱镁叶绿酸a甲酯
英文名	Methyl phaeophorbide
英文别名	3-Phorbinepropionic acid, 21-carboxy-14-ethyl-4,8,13,18-tetramethyl-20-oxo-9-vinyl-, dimethyl ester Methyl phaeophorbide Methyl phaeophorbide A Methylpheophorbide pheophorbideaMethylester phaeophorbide a methyl ester Methyl 14-ethyl-3-(3-methoxy-3-oxopropyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-21-carboxylate 3-Phorbinepropionic acid, 21-carboxy-14-ethyl-4,8,13,18-tetramethyl-20-oxo-9-vinyl-, dimethyl ester (VAN) (8CI) Methyl 14-ethyl-3-(3-methoxy-3-oxopropyl)-4,8,13,18-tetramethyl-20-oxo-9-vinyl-21-phorbinecarboxylate Pheo a methyl ester 3-Phorbinepropanoic acid, 9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-, methyl ester Phaeophorbid A,methyl ester Methyl (3S-(3α,4β,21β))-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionate methyl 9-ethenyl-14-ethyl-3-(3-methoxy-3-oxopropyl)-4,8,13,18-tetramethyl-20-oxophorbine-21-carboxylate Methyl pheophorbide a Methyl (3S-(3a,4b,21b))-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionate EINECS 227-007-3 Demagnesia chloric acid -a methyl ester

描述	脱镁酸甲酯a是一种天然产物,是叶绿素a衍生物之一[1][2]。
相关类别	研究领域 >> 其他信号通路 >> 其他 >> 其他
参考文献	[1]. F.C. Pennington, et al. Preparation and Properties of Pyrochlorophyll a, Methyl Pyrochlorophyllide a, Pyropheophytin a, and Methyl Pyropheophorbide a Derived from Chlorophyll by Decarbomethoxylation. J. Am. Chem. Soc. 1964, 86, 7, 1418-1426. [2]. ShinOgasawara, et al. C132-Methylation of methyl pheophorbide a and stereoselective preparation of methyl (132R)-methylpyropheophorbide a. Tetrahedron Letters, 2014, 3618-3621.

密度	1.2±0.1 g/cm3
沸点	956.2±65.0 °C at 760 mmHg
分子式	C₃₆H₃₈N₄O₅
分子量	606.711
闪点	532.1±34.3 °C
精确质量	606.284241
PSA	125.97000
LogP	7.22
蒸汽压	0.0±0.3 mmHg at 25°C
折射率	1.611
计算化学	1.疏水参数计算参考值（XlogP）:5.5 2.氢键供体数量:2 3.氢键受体数量:7 4.可旋转化学键数量:8 5.互变异构体数量:1001 6.拓扑分子极性表面积127 7.重原子数量:45 8.表面电荷:0 9.复杂度:1150 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:3 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1