+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 91Q | ||
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Name | Name: Comment | alkaloid*YM | |
-Chemical information
Composition | Formula: C12H16N2O / Number of atoms: 31 / Formula weight: 204.268 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: 91Q / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7WC5 | ||||
History |
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External links | BindingDB / UniChem / Brenda / ChEBI / ChEMBL / CompTox / GtoPharmacology / HMDB / KEGG_Ligand / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / 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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