+Open data
-Basic information
Entry | Database: PDB chemical components / ID: YO3 |
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Name | Name: Synonyms: 3-methyl-2-[(1E,3E)-3-(1-methylquinolin-4(1H)-ylidene)prop-1-en-1-yl]-1,3-benzoxazol-3-ium |
-Chemical information
Composition | Formula: C21H19N2O / Number of atoms: 43 / Formula weight: 315.388 / Formal charge: 1 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: YO3 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6UP0 | ||||||
History |
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External links | UniChem / ChemSpider / PubChem / SureChEMBL / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | |
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-PDB entries
Showing all 1 items
PDB-6up0:
Structure of the Mango-III fluorescent aptamer bound to YO3-Biotin