+Open data
-Basic information
Entry | Database: PDB chemical components / ID: MLI | ||
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Name | Name: Wikipedia | Wikipedia - Malonic acid: Malonic acid (IUPAC systematic name: propanedioic acid) is a dicarboxylic acid with structure CH2(COOH)2. The ionized form of malonic acid, as well as its esters and salts, are known as malonates... | |
-Chemical information
Composition | Formula: C3H2O4 / Number of atoms: 9 / Formula weight: 102.046 / Formal charge: -2 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: MLI / Model coordinates PDB-ID: 1UFY | ||||
History |
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External links | UniChem / BindingDB / ChEBI / ChemicalBook / CompTox / DrugBank / Metabolights / NMRShiftDB / Nikkaji / PubChem / Rhea / SwissLipids / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | [CACTVS 3.341 | [ | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | [OpenEye OEToolkits 1.5.0 | |
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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 1.5.0 | |
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