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- ChemComp-9B4: (2R,5R,13R,16R)-9-(hydroxymethyl)-9-{[(2R)-2-hydroxypropoxy]methy... -
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Open data
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Basic information
Entry | ![]() |
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Name | Name: ( Synonyms: Pentaerythritol propoxylate (5/4 PO/OH) |
-Chemical information
Composition | |||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 9B4 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5VHV | ||||||
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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-Details
-SMILES
ACDLabs 12.01 | 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
ACDLabs 12.01 | (OpenEye OEToolkits 2.0.6 | |
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-PDB entries
Showing all 1 items
![](data/pdb/img/5vhv.jpg)
PDB-5vhv:
Pseudomonas fluorescens alkylpurine DNA glycosylase AlkC bound to DNA containing an oxocarbenium-intermediate analog