+Open data
-Basic information
Entry | Database: PDB chemical components / ID: MCU |
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Name | Name: Synonyms: methyl (2S,3S,4R,5R,6R)-3-methoxy-4,5,6-tris(oxidanyl)oxane-2-carboxylate |
-Chemical information
Composition | Formula: C8H14O7 / Number of atoms: 29 / Formula weight: 222.193 / Formal charge: 0 | ||||||||||||||||||
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Others | Type: D-saccharide, beta linking / PDB classification: ATOMS / Three letter code: MCU / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4G4J / Parent comp.: BDP | ||||||||||||||||||
History |
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External links | UniChem / ChemSpider / PubChem / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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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 1.7.6 | |
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-IUPAC CARBOHYDRATE SYMBOL
PDB-CARE 1.0 |
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-PDB entries
Showing all 1 items
PDB-4g4j:
Crystal structure of glucuronoyl esterase S213A mutant from Sporotrichum thermophile in complex with methyl 4-O-methyl-beta-D-glucopyranuronate determined at 2.35 A resolution