22350-60-3 (谷氨酸，N-[4-[（2-氨基-5-甲酰基-3,4,5,6,7,8-六氢-4-氧代-6-蝶烷基）甲基]氨基]苯甲酰基]-,Glutamic acid,N-[4-[[(2-amino-5-formyl-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-)

快速询单

结构式：

谷氨酸，N-[4-[（2-氨基-5-甲酰基-3,4,5,6,7,8-六氢-4-氧代-6-蝶烷基）甲基]氨基]苯甲酰基]-MOL文件

CAS号：

22350-60-3

中文名称：

谷氨酸，N-[4-[（2-氨基-5-甲酰基-3,4,5,6,7,8-六氢-4-氧代-6-蝶烷基）甲基]氨基]苯甲酰基]-

英文名称：

Glutamic acid,N-[4-[[(2-amino-5-formyl-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-

分子式：

C₂₀H₂₃N₇O₇

分子量：

473.439323663712

谷氨酸，N-[4-[（2-氨基-5-甲酰基-3,4,5,6,7,8-六氢-4-氧代-6-蝶烷基）甲基]氨基]苯甲酰基]-(22350-60-3)名称与标识符

名称

英文别名：

Glutamic acid,N-[4-[[(2-amino-5-formyl-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-;(?à)-Folinicacid;dl-Folinic acid;DL-Glutamicacid, N-[4-[[(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-;DL-N5-Formyltetrahydrofolic acid;Glutamic acid,N-[4-[[(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-(9CI);Glutamic acid,N-[p-[[(2-amino-5-formyl-5,6,7,8-tetrahydro-4-hydroxy-6-pteridinyl)methyl]amino]benzoyl]-,DL- (8CI);NS00078949;N-[(4-{[(2-amino-5-formyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)carbonyl]glutamic acid;2-(4-(((5-Formyl-2-imino-4-oxo-1,2,3,4,5,6,7,8-octahydropteridin-6-yl)methyl)amino)benzamido)pentanedioic acid;Levofolinic Acid;Levoleucovorin;L-Folinic acid;Calcium Levofolinate EP Impurity H,Calcium Folinate Hydrate H;DTXSID30859023;BCP31586;Rescuvolin (TN);(+/-)-Folinic acid;(6R)-FolinicAcid;DL-Glutamic acid, N-(4-(((2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-;folinsaure;2-[[4-[(2-amino-5-formyl-4-hydroxy-7,8-dihydro-6H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid;NCI60_003255;CHEMBL69905;22350-60-3;Folinic acid (BAN);leucovorin;(+-)-Folinic acid;AKOS037643636;AS-19313;Folinic Acid Impurity H;58-05-9;D07986;SCHEMBL36113;

标识符

InChIKey：

VVIAGPKUTFNRDU-UHFFFAOYSA-N

Inchi：

1S/C20H23N7O7/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32)

SMILES：

O=C1C2=C(N=C(N)N1)NCC(CNC1C=CC(C(NC(C(=O)O)CCC(=O)O)=O)=CC=1)N2C=O

谷氨酸，N-[4-[（2-氨基-5-甲酰基-3,4,5,6,7,8-六氢-4-氧代-6-蝶烷基）甲基]氨基]苯甲酰基]-(22350-60-3)物化性质

实验特性

LogP : log Kow = -4.45 /Estimated/
PSA : 215.55

计算特性

精确分子量 : 473.16609
氢键供体数量 : 8
氢键受体数量 : 14
可旋转化学键数量 : 11
同位素质量 : 473.16589610g/mol
重原子数量 : 34
复杂度 : 911
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 2
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : -1.2
拓扑分子极性表面积 : 216Å²

谷氨酸，N-[4-[（2-氨基-5-甲酰基-3,4,5,6,7,8-六氢-4-氧代-6-蝶烷基）甲基]氨基]苯甲酰基]-(22350-60-3)相关文献

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