Structure Information
Structure

Compound Identification

SMILES

OS(O)(=O)=O.CNC(C)CC1=CC=C(O)C=C1.C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(OC4=CC(OCCO)=CC(OCCO)=C4C3=O)C3=CC(O)=C(OCCO)C=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O.O=C(OC1C(OC(=O)C2=CN=CC=C2)C(OC(=O)C2=CN=CC=C2)C(OC(=O)C2=CN=CC=C2)C(OC(=O)C2=CN=CC=C2)C1OC(=O)C1=CN=CC=C1)C1=CN=CC=C1

InChIKey

InChIKey=WKMVSKLDXSNCDE-WUYIGRECSA-N

Formula

C85H89N7O36S

Mass

1816.72

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Entity with smiles OS(O)(=O)=O.CNC(C)CC1=CC=C(O)C=C1.C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(OC4=CC(OCCO)=CC(OCCO)=C4C3=O)C3=CC(O)=C(OCCO)C=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O.O=C(OC1C(OC(=O)C2=CN=CC=C2)C(OC(=O)C2=CN=CC=C2)C(OC(=O)C2=CN=CC=C2)C(OC(=O)C2=CN=CC=C2)C1OC(=O)C1=CN=CC=C1)C1=CN=CC=C1 has not been classified yet.

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