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- ChemComp-GO9: 3-(2-hydroxyethyloxy)-2-[2-(2-hydroxyethyloxy)ethoxymethyl]-2-(2-... -

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Basic information

EntryDatabase: PDB chemical components / ID: GO9
NameName: 3-(2-hydroxyethyloxy)-2-[2-(2-hydroxyethyloxy)ethoxymethyl]-2-(2-hydroxyethyloxymethyl)propan-1-ol

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Chemical information

Composition
Formula: C13H28O8 / Number of atoms: 49 / Formula weight: 312.357 / Formal charge: 0
Others

7d0e

Type: non-polymer / PDB classification: HETAIN / Three letter code: GO9 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7D0E
History
Create componentSep 11, 2020
Initial releaseMar 31, 2021
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

CACTVS 3.385OCCOCCOCC(CO)(COCCO)COCCO
OpenEye OEToolkits 2.0.7C(COCCOCC(CO)(COCCO)COCCO)O

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SMILES CANONICAL

CACTVS 3.385OCCOCCOCC(CO)(COCCO)COCCO
OpenEye OEToolkits 2.0.7C(COCCOCC(CO)(COCCO)COCCO)O

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InChI

InChI 1.03InChI=1S/C13H28O8/c14-1-4-18-7-8-21-12-13(9-17,10-19-5-2-15)11-20-6-3-16/h14-17H,1-12H2

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InChIKey

InChI 1.03CLVWRDZKTFFQRY-UHFFFAOYSA-N

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PDB entries

Showing all 1 items

PDB-7d0e:
Crystal structure of FIP200 Claw/p-CCPG1 FIR2

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