+Open data
-Basic information
Entry | Database: PDB chemical components / ID: ROS |
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Name | Name: Synonyms: (6-DIMETHYLAMINO-9-PHENYL-XANTHEN-3-YLIDENE)-DIMETHYL-AMMONIUM |
-Chemical information
Composition | Formula: C23H23N2O / Number of atoms: 49 / Formula weight: 343.442 / Formal charge: 1 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: ROS / Model coordinates PDB-ID: 1F1T | ||||||||
History |
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External links | UniChem / ChemSpider / Brenda / ChEBI / ChEMBL / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | ( | |
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-PDB entries
Showing all 1 items
PDB-1f1t:
CRYSTAL STRUCTURE OF THE MALACHITE GREEN APTAMER COMPLEXED WITH TETRAMETHYL-ROSAMINE