+Open data
-Basic information
Entry | Database: PDB chemical components / ID: NPS | ||
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Name | Name: (Comment | antiinflammatory*YM | |
-Chemical information
Composition | Formula: C14H14O3 / Number of atoms: 31 / Formula weight: 230.259 / Formal charge: 0 | ||||||||||
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Others | Type: non-polymer / PDB classification: HETAD / Three letter code: NPS / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2VDB | ||||||||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DailyMed / DrugBank / GtoPharmacology / HMDB / NMRShiftDB / 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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