+Open data
-Basic information
Entry | Database: PDB chemical components / ID: JHD |
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Name | Name: |
-Chemical information
Composition | Formula: C9H13NO2 / Number of atoms: 25 / Formula weight: 167.205 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: JHD / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5QE7 | ||||
History |
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External links | UniChem / ChemSpider / Brenda / ChemicalBook / CompTox / 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 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.6 | ( | |
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-PDB entries
Showing all 4 items
PDB-5qe7:
PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with compound_FMOPL000601a
PDB-5s4x:
Tubulin-Z2856434917-complex
PDB-7fqx:
PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with FMOPL000601a
PDB-7frl:
PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with Z2856434917