Structure Information
Structure

Compound Identification

SMILES

CC(=O)NCSC[C@H](NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)C1=CC=C(C)C=C1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)NC(=O)[C@H](CC(=O)OC1CCCCC1)NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)C1=CC=C(C)C=C1)NC(=O)[C@H](CC1=CN(COCC2=CC=CC=C2)C=N1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1=CC=C(OC(=O)OCC2=CC=CC=C2Br)C=C1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCNC(=O)OCC1=CC=CC=C1Cl)C(O)=O

InChIKey

InChIKey=GOWWPNJIEFQHFP-GWUKXZCRSA-N

Formula

C105H136BrClN22O28S3

Mass

2365.9

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Entity with smiles CC(=O)NCSC[C@H](NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)C1=CC=C(C)C=C1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)NC(=O)[C@H](CC(=O)OC1CCCCC1)NC(=O)[C@H](CCCNC(=N)NS(=O)(=O)C1=CC=C(C)C=C1)NC(=O)[C@H](CC1=CN(COCC2=CC=CC=C2)C=N1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1=CC=C(OC(=O)OCC2=CC=CC=C2Br)C=C1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCNC(=O)OCC1=CC=CC=C1Cl)C(O)=O has not been classified yet.

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