+Open data
-Basic information
Entry | Database: PDB chemical components / ID: CBW | ||
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Name | Name: (Comment | antiinflammatory*YM | |
-Chemical information
Composition | Formula: C30H46O4 / Number of atoms: 80 / Formula weight: 470.684 / Formal charge: 0 | ||||
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Others | Type: non-polymer / Three letter code: CBW / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2W4Q | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DrugBank / GtoPharmacology / KEGG_Ligand / LipidMaps / Metabolights / NMRShiftDB / Nikkaji / 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 3.352 | OpenEye OEToolkits 1.6.1 | |
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-SMILES CANONICAL
CACTVS 3.352 | OpenEye OEToolkits 1.6.1 | |
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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 1.6.1 | ( | |
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-PDB entries
Showing all 3 items
PDB-2w4q:
Crystal structure of human zinc-binding alcohol dehydrogenase 1 (ZADH1) in ternary complex with NADP and 18beta-glycyrrhetinic acid
PDB-4pv5:
Crystal structure of mouse glyoxalase I in complexed with 18-beta-glycyrrhetinic acid
PDB-5c71:
The structure of Aspergillus oryzae a-glucuronidase complexed with glycyrrhetinic acid monoglucuronide