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Search term: CDQDKMKLXTUANG
Found by InChIKey (skeleton match)
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Inherent Properties, Identifiers and References
ChemSpider ID: 2815167
Empirical Formula: C26H32N2O9
Molecular Weight: 516.5403
Nominal Mass: 516 Da
Average Mass: 516.5403 Da
Monoisotopic Mass: 516.210781 Da
Systematic Name: ethyl 5-[({[3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbo​nyl}oxy)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
SMILES: O=C(N1CCOCC1)COc3ccc(C(=O)OCC(=O)c2c(c(C(=O)OCC)c(n2)C)C)cc3OCC Copy
InChI: InChI=1/C26H32N2O9/c1-5-34-21-13-18(7-8-20(21)36-15-22(30)28-9-11​-33-12-10-28)25(31)37-14-19(29)24-16(3)23(17(4)27-24)26(32)35-6-2​/h7-8,13,27H,5-6,9-12,14-15H2,1-4H3 Copy
InChIKey: CDQDKMKLXTUANG-UHFFFAOYAL
Std. InChI: Copy
Std. InChIKey: -
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SimBioSys LASSO