Structure Information
Structure

Compound Identification

SMILES

CC[N+]1=C(\C=C\C=C\C=C2\N(CCCCCCC(=O)NCCCC[C@@H](NC(=O)[C@@H](CC3=CC=CC=C3)NC(=O)OCC3=CC=CC=C3)C(=O)COC(=O)C(C)(C)NC(=O)C3CCN(CC3)S(=O)(=O)C3=CC=CC=C3C3=C4C=CC(=CC4=[O+]C4=C3C=CC(=C4)N(C)C3=CC=CC=C3)N3CCC4=CC=CC=C34)C3=C(C=C(C=C3)S([O-])(=O)=O)C2(C)C)C(C)(C)C2=C1C=CC(=C2)S([O-])(=O)=O

InChIKey

InChIKey=VZTZHQAEQCZGNC-KARIZSNOSA-N

Formula

C102H111N9O17S3

Mass

1831.24

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Entity with smiles CC[N+]1=C(\C=C\C=C\C=C2\N(CCCCCCC(=O)NCCCC[C@@H](NC(=O)[C@@H](CC3=CC=CC=C3)NC(=O)OCC3=CC=CC=C3)C(=O)COC(=O)C(C)(C)NC(=O)C3CCN(CC3)S(=O)(=O)C3=CC=CC=C3C3=C4C=CC(=CC4=[O+]C4=C3C=CC(=C4)N(C)C3=CC=CC=C3)N3CCC4=CC=CC=C34)C3=C(C=C(C=C3)S([O-])(=O)=O)C2(C)C)C(C)(C)C2=C1C=CC(=C2)S([O-])(=O)=O has not been classified yet.

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