+Open data
-Basic information
Entry | Database: PDB chemical components / ID: S3M |
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Name | Name: ( |
-Chemical information
Composition | Formula: C11H12N2O / Number of atoms: 26 / Formula weight: 188.226 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: S3M / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5RAI | ||||||
History |
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External links | UniChem / ChemSpider / ChEBI / CompTox / PubChem / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
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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-PDB entries
Showing all 1 items
PDB-5rai:
PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with XS040404c