Structure Information
Structure

Compound Identification

SMILES

CC(C)C[C@H](N=C(O)[C@H](CCC(O)=N)N=C(O)[C@H](CCC(O)=O)N=C(O)[C@H](CC1=CNC2=CC=CC=C12)N=C(O)[C@@H](N)CS)C(O)=N[C@@H](CC(O)=O)C(O)=NCC(O)=N[C@@H](C(C)C)C(O)=N[C@@H]([C@@H](C)O)C(O)=N[C@@H](CC1=CNC2=CC=CC=C12)C(O)=N[C@@H](C(C)C)C(O)=N[C@@H](CC1=CNC2=CC=CC=C12)C(O)=N[C@@H](CCCNC(N)=N)C(O)=N[C@@H](CS)C(O)=O

InChIKey

InChIKey=AWNMJJICBXQNGI-NGQWUGHQSA-N

Formula

C81H113N21O21S2

Mass

1781.04

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Entity with smiles CC(C)C[C@H](N=C(O)[C@H](CCC(O)=N)N=C(O)[C@H](CCC(O)=O)N=C(O)[C@H](CC1=CNC2=CC=CC=C12)N=C(O)[C@@H](N)CS)C(O)=N[C@@H](CC(O)=O)C(O)=NCC(O)=N[C@@H](C(C)C)C(O)=N[C@@H]([C@@H](C)O)C(O)=N[C@@H](CC1=CNC2=CC=CC=C12)C(O)=N[C@@H](C(C)C)C(O)=N[C@@H](CC1=CNC2=CC=CC=C12)C(O)=N[C@@H](CCCNC(N)=N)C(O)=N[C@@H](CS)C(O)=O has not been classified yet.

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