+Open data
-Basic information
Entry | Database: PDB chemical components / ID: T83 |
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Name | Name: |
-Chemical information
Composition | Formula: C10H8O4 / Number of atoms: 22 / Formula weight: 192.168 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: T83 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8DQP | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / HMDB / KEGG_Ligand / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / Rhea / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | 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 1.06 |
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-InChIKey
InChI 1.06 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | |
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-PDB entries
Showing all 4 items
PDB-8dqp:
Crystal structure of Arabidopsis thaliana COSY in complex with scopoletin
PDB-8j2s:
Glucosyl transferase NbUGT72AY1 co-crystallized with Scopoletin, UDP-2F Glucose and Retinol
PDB-8j2t:
Glucosyl Transferase NbUGT72AY1 co-crystallized with UDP-2F glucose and Scopoletin
PDB-8j2v:
Glucosyl transferase NbUGT72AY1 co-crystallized with Scopoletin