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Yorodumi- ChemComp-6ON: 2-[(9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-t... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 6ON |
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Name | Name: 2-[(9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,7,10,12-pentaen-9-yl]-~{N}-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(9~{S})-7-(4-chlorophenyl)- ...Name: |
-Chemical information
Composition | Formula: C54H66Cl2N10O9S2 / Number of atoms: 143 / Formula weight: 1134.199 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 6ON / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5JWM | ||||||
History |
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External links | UniChem / ChemSpider / Nikkaji / PubChem / SureChEMBL / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.5 |
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-PDB entries
Showing all 1 items
PDB-5jwm:
Bivalent BET Bromodomain Inhibition