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BDBM300745 US10130642, Example 4-47

SMILES: OCC(CC(Cc1ccccc1)NC(=O)c1cnc(O)nc1)C(O)=O

InChI Key: InChIKey=AGWMWLZPQYUIRH-UHFFFAOYSA-N

Data: 1 KI

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