Structure Information
Structure

Compound Identification

SMILES

CS(O)(=O)=O.CCC1=C(NC)N=C(CC[C@H]2CCN(CC(=O)N[C@@H](CC(O)=O)C3=CN=CC=C3)C2=O)C=C1.CC(C)(N)C(=O)N[C@H](COCC1=CC=CC=C1)C(=O)N1CCC2(CN(C3=CC=CC=C23)S(C)(=O)=O)CC1

InChIKey

InChIKey=XAOWMNBAVQDQSR-WQDYQDSXSA-N

Formula

C52H71N9O12S2

Mass

1078.31

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Entity with smiles CS(O)(=O)=O.CCC1=C(NC)N=C(CC[C@H]2CCN(CC(=O)N[C@@H](CC(O)=O)C3=CN=CC=C3)C2=O)C=C1.CC(C)(N)C(=O)N[C@H](COCC1=CC=CC=C1)C(=O)N1CCC2(CN(C3=CC=CC=C23)S(C)(=O)=O)CC1 has not been classified yet.

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