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- ChemComp-GOL: GLYCEROL -

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Basic information

EntryDatabase: PDB chemical components / ID: GOL
NameName: glycerol / Synonyms: GLYCERIN; PROPANE-1,2,3-TRIOL
WikipediaWikipedia - Glycerol: Glycerol (), also called glycerine or glycerin, is a simple triol compound. It is a colorless, odorless, viscous liquid that is sweet-tasting and non-toxic...

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Chemical information

Composition
Formula: C3H8O3 / Number of atoms: 14 / Formula weight: 92.094 / Formal charge: 0
Others

1bxo

CRY

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: GOL / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1BXO / Replaces: CRY
History
Create componentJul 8, 1999
Modify descriptorJun 4, 2011
Modify synonymsMay 28, 2020
External linksUniChem / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DailyMed / DrugBank / GtoPharmacology / HMDB / KEGG_Ligand / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / Rhea / SureChEMBL / ZINC / 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

ACDLabs 12.01OCC(O)CO
CACTVS 3.370OCC(O)CO
OpenEye OEToolkits 1.7.0C(C(CO)O)O

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SMILES CANONICAL

CACTVS 3.370OCC(O)CO
OpenEye OEToolkits 1.7.0C(C(CO)O)O

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InChI

InChI 1.03InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2

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InChIKey

InChI 1.03PEDCQBHIVMGVHV-UHFFFAOYSA-N

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SYSTEMATIC NAME

ACDLabs 12.01propane-1,2,3-triol
OpenEye OEToolkits 1.7.0propane-1,2,3-triol

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