Structure Information
Structure

Compound Identification

SMILES

C(CNCC1=CC=CC=C1)NCC1=CC=CC=C1.CO\N=C(\C(=O)N[C@@H]1[C@@H]2SCC(COC(C)=O)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1.CO\N=C(\C(=O)N[C@@H]1[C@@H]2SCC(COC(C)=O)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1

InChIKey

InChIKey=IILSVORLNYJFCF-RHTQRPDXSA-N

Formula

C48H54N12O14S4

Mass

1151.27

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Entity with smiles C(CNCC1=CC=CC=C1)NCC1=CC=CC=C1.CO\N=C(\C(=O)N[C@@H]1[C@@H]2SCC(COC(C)=O)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1.CO\N=C(\C(=O)N[C@@H]1[C@@H]2SCC(COC(C)=O)=C(N2C1=O)C(O)=O)C1=CSC(N)=N1 has not been classified yet.

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