钆塞酸

CAS号
135326-11-3
CCD编号
CCD00175884
分子式
C23 H30 Gd N3 O11
分子量
681.75

基本信息

产品名称: 钆塞酸
CAS: 135326-11-3
中文同义词: 钆塞酸
英文同义词: GADOXETIC ACID
MDL号: MFCD00867286
氢键受体数量: 14
氢键供体数量: 2
Smile: CCOc1ccc(cc1)C[C@H]2CN(CCN(CC(=O)O[Gd]3OC(=O)CN2CC(=O)O3)CC(=O)O)CC(=O)O
InChi: InChI=1S/C23H33N3O11.Gd/c1-2-37-18-5-3-16(4-6-18)9-17(26(14-22(33)34)15-23(35)36)10-24(11-19(27)28)7-8-25(12-20(29)30)13-21(31)32;/h3-6,17H,2,7-15H2,1H3,(H,27,28)(H,29,30)(H,31,32)(H,33,34)(H,35,36);/q;+3/p-3/t17-;/m0./s1
InChiKey: InChIKey=PCZHWPSNPWAQNF-LMOVPXPDSA-K

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