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SMILES: CCCCCCCCCCCCCCCCCC(=O)NCCOCCOCCNC(=O)CN1CCN2CCN(CC(=O)O[Gd](OC(=O)C2)OC(=O)C1)CC(=O)NCCOCCOCCNC(=O)CCCCCCCCCCCCCCCCC Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)NCCOCCOCCNC(=O)CN1CCN2CCN(CC(=O)NCCOCCOCCNC(=O)CCCCCCCCCCCCCCCCC)CC(=O)O[Gd](OC(=O)C1)OC(=O)C2 InChI: InChI=1S/C62H119N7O14.Gd/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-56(70)63-35-43-80-47-49-82-45-37-65-58(72)51-68(54-61(76)77)41-39-67(53-60(74)75)40-42-69(55-62(78)79)52-59(73)66-38-46-83-50-48-81-44-36-64-57(71)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h3-55H2,1-2H3,(H,63,70)(H,64,71)(H,65,72)(H,66,73)(H,74,75)(H,76,77)(H,78,79);/q;+3/p-3 InChIKey: YCQABDWULYMBBW-UHFFFAOYSA-K
CBID:131144 http://www.chembase.cn/molecule-131144.html