+Open data
-Basic information
Entry | Database: PDB chemical components / ID: U5B |
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Name | Name: Synonyms: (Acenaphthen-5-ylsulfanyl)-acetic acid |
-Chemical information
Composition | Formula: C14H12O2S / Number of atoms: 29 / Formula weight: 244.309 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: U5B / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7BNC | ||||
History |
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External links | UniChem / ChemSpider / PubChem / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
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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-PDB entries
Showing all 1 items
PDB-7bnc:
Notum fragment_126 (2-(1,2-dihydroacenaphthylen-5-ylsulfanyl)acetic acid)