Structure Information
Structure

Compound Identification

SMILES

CC[C@@](OC(=O)[C@H]1CC2=CC=CC=C2CN1S(=O)(=O)C1=CC=C(C=C1)C1=CC=CC=C1)(C(O)=O)C1=C(C#N)C(=O)N2CCC3(CC(C)(C)COO3)C2=C1

InChIKey

InChIKey=IIYGWWHKWOFAFY-NPTAUUEMSA-N

Formula

C40H39N3O9S

Mass

737.82

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Entity with smiles CC[C@@](OC(=O)[C@H]1CC2=CC=CC=C2CN1S(=O)(=O)C1=CC=C(C=C1)C1=CC=CC=C1)(C(O)=O)C1=C(C#N)C(=O)N2CCC3(CC(C)(C)COO3)C2=C1 has not been classified yet.

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