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Yorodumi- ChemComp-R4T: 9-[(1~{R},3~{R},6~{R},8~{R},9~{R},10~{R},12~{R},15~{R},17~{R},18~... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: R4T |
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Name | Name: 9-[(1~{R},3~{R},6~{R},8~{R},9~{R},10~{R},12~{R},15~{R},17~{R},18~{R})-17-(6-aminopurin-9-yl)-9,18-bis(fluoranyl)-3,12-bis(oxidanylidene)-3,12-bis(sulfanyl)-2,4,7,11,13,16-hexaoxa- ...Name: |
-Chemical information
Composition | Formula: C20H24F2N10O8P2S2 / Number of atoms: 68 / Formula weight: 696.541 / Formal charge: 2 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: R4T / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7A90 | ||||||
History |
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External links | UniChem / ChEMBL / SureChEMBL / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | [OpenEye OEToolkits 3.1.0.0 | |
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-SMILES CANONICAL
CACTVS 3.385 | [OpenEye OEToolkits 3.1.0.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-7a90:
WT STING in complex with 3',3'-c-di[2'FdAM(PS)]