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Yorodumi- ChemComp-RI5: (1aR,2aR,3S,6R,6aS,8aS,8bR,9R)-2a-hydroxy-8b-methyl-9-(prop-1-en-... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: RI5 | ||||
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Name | Name: ( Synonyms: PICROTOXIN Wikipedia | Wikipedia - Picrotoxin: Picrotoxin, also known as cocculin, is a poisonous crystalline plant compound. It was first isolated by the French pharmacist and chemist Pierre François Guillaume Boullay (1777–1869) in 1812... | Comment | toxin*YM | |
-Chemical information
Composition | Formula: C15H16O6 / Number of atoms: 37 / Formula weight: 292.284 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: RI5 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3RI5 | ||||||
History |
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External links | UniChem / BindingDB / ChEBI / ChEMBL / ChemicalBook / CompTox / GtoPharmacology / KEGG_Ligand / LipidMaps / Metabolights / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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