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- ChemComp-GOA: GLYCOLIC ACID -

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Basic information

EntryDatabase: PDB chemical components / ID: GOA
NameName: glycolic acid / Synonyms: HYDROXYACETIC ACID; HYDROXYETHANOIC ACID

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Chemical information

Composition
Formula: C2H4O3 / Number of atoms: 9 / Formula weight: 76.051 / Formal charge: 0
Others

1qki

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: GOA / Ideal coordinates details: Corina / Model coordinates PDB-ID: 1QKI
History
Create componentJul 21, 1999
Modify leaving atom flagJan 13, 2011
Modify descriptorJun 4, 2011
Modify synonymsJun 5, 2020
Modify backboneNov 3, 2023
External linksUniChem / ChemSpider / Brenda / ChEBI / ChEMBL / ChemicalBook / CompTox / DrugBank / HMDB / KEGG_Ligand / Metabolights / NMRShiftDB / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / 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 12.01O=C(O)CO
CACTVS 3.370OCC(O)=O
OpenEye OEToolkits 1.7.0C(C(=O)O)O

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SMILES CANONICAL

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

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InChI

InChI 1.03InChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5)

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InChIKey

InChI 1.03AEMRFAOFKBGASW-UHFFFAOYSA-N

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SYSTEMATIC NAME

ACDLabs 12.01hydroxyacetic acid
OpenEye OEToolkits 1.7.02-hydroxyethanoic acid

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