Marvin  01141111432D          

  8  7  0  0  0  0            999 V2000
    7.9249   -8.9517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6394   -8.5393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3539   -8.9517    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6394   -7.7143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2105   -8.5393    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    6.4960   -8.9517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2105   -7.7143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2105   -9.3642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
M  END
> <ID>
CHEBI:18124

> <NAME>
phosphonoacetaldehyde

> <DEFINITION>
A phosphonic acid consisting of acetaldehyde with the phospho group at the 2-position.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:8155; CHEBI:11653; CHEBI:45088; CHEBI:14823; CHEBI:26070

> <SYNONYM>
Phosphonoacetaldehyde; 2-Phosphonoacetaldehyde; 2-Oxoethylphosphonate

> <IUPAC_NAME>
(2-oxoethyl)phosphonic acid

> <FORMULA>
C2H5O4P

> <MASS>
124.03250

> <MONOISOTOPIC_MASS>
123.99255

> <CHARGE>
0

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

> <INCHI>
InChI=1S/C2H5O4P/c3-1-2-7(4,5)6/h1H,2H2,(H2,4,5,6)

> <INCHIKEY>
YEMKIGUKNDOZEG-UHFFFAOYSA-N

> <DRUGBANK_ACCESSION>
DB03174

> <KEGG_COMPOUND_ACCESSION>
C03167

> <KNAPSACK_ACCESSION>
C00000799

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