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Yorodumi- ChemComp-17B: (2Z,3R,4S,5R,6R)-2-[(4-aminobutyl)imino]-6-(hydroxymethyl)piperid... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 17B |
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Name | Name: ( |
-Chemical information
Composition | Formula: C10H21N3O4 / Number of atoms: 38 / Formula weight: 247.291 / Formal charge: 0 | ||||
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Others | Type: non-polymer / Three letter code: 17B / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2VR4 | ||||
History |
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External links | UniChem / ChemSpider / ChEMBL / Nikkaji / PubChem / PubChem_TPharma / ZINC / 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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-PDB entries
Showing all 1 items
PDB-2vr4:
Transition-state mimicry in mannoside hydrolysis: characterisation of twenty six inhibitors and insight into binding from linear free energy relationships and 3-D structure