+Open data
-Basic information
Entry | Database: PDB chemical components / ID: ZMR | ||
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Name | Name: Synonyms: 4-GUANIDINO-2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID; 4-guanidino-Neu5Ac2en; MODIFIED SIALIC ACID Comment | medication, inhibitor*YM | |
-Chemical information
Composition | Formula: C12H20N4O7 / Number of atoms: 43 / Formula weight: 332.31 / Formal charge: 0 | ||||||||||||
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Others | Type: D-saccharide / PDB classification: ATOMS / Three letter code: ZMR / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1A4G | ||||||||||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DailyMed / DrugBank / HMDB / KEGG_Ligand / 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 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | [ | |
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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 2.0.7 | ( | |
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