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Yorodumi- ChemComp-962: (2~{S})-1-[2-hydroxyethyl-[(2~{S})-2-oxidanylpropyl]amino]propan-2-ol -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 962 |
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Name | Name: ( |
-Chemical information
Composition | Formula: C8H19NO3 / Number of atoms: 31 / Formula weight: 177.241 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 962 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5NRS | ||||
History |
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External links | UniChem / ChemSpider / Nikkaji / PubChem / 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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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.6 | ( |
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-PDB entries
Showing all 1 items
PDB-5nrs:
Human DNMT3B PWWP domain in complex with N,N-bis(2-hydroxypropyl)ethanolamine