Ketcher 06062214052D 1   1.00000     0.00000     0

  5  4  0     0  0            999 V2000
    6.4933   -3.9059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3575   -5.3874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6084   -4.4165    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3575   -4.3998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2196   -3.9021    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  2  0     0  0
  1  4  1  0     0  0
  3  1  1  0     0  0
  4  5  1  0     0  0
M  END
> <ID>
CHEBI:17071

> <NAME>
glycolaldehyde

> <DEFINITION>
The glycolaldehyde derived from ethylene glycol. The parent of the class of glycolaldehydes.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:5474; CHEBI:14347; CHEBI:24386

> <SYNONYM>
Monomethylolformaldehyde; Methylol formaldehyde; Hydroxyacetaldehyde; glycollaldehyde; Glycolic aldehyde; glycolaldehyde; Glycolaldehyde; GLYCOALDEHYDE

> <IUPAC_NAME>
hydroxyacetaldehyde

> <FORMULA>
C2H4O2

> <MASS>
60.052

> <MONOISOTOPIC_MASS>
60.02113

> <CHARGE>
0

> <SMILES>
[H]C(=O)CO

> <INCHI>
InChI=1S/C2H4O2/c3-1-2-4/h1,4H,2H2

> <INCHIKEY>
WGCNASOHLSPBMP-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
506029

> <CAS_REGISTRY_NUMBER>
141-46-8

> <REAXYS_REGISTRY_NUMBER>
506029

> <CHEMIDPLUS>
141-46-8

> <ECMDB_ACCESSION>
ECMDB02165

> <KEGG_COMPOUND_ACCESSION>
C00266

> <KNAPSACK_ACCESSION>
C00007457

> <METACYC_ACCESSION>
GLYCOLALDEHYDE

> <NIST_CHEMISTRY_WEBBOOK>
141-46-8

> <PDBECHEM_ACCESSION>
DW3

> <WIKIPEDIA_ACCESSION>
Glycolaldehyde

> <YMDB_ACCESSION>
YMDB00343

> <PUBMED_CITATION>
20960220; 21378371; 21472960; 21820089; 23543734; 29400466; 35348319; 35624799

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