Marvin  02280811262D          

  8  8  0  0  0  0            999 V2000
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    0.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  8  1  2  0  0  0  0
  2  1  1  0  0  0  0
  1  3  1  0  0  0  0
  4  3  1  0  0  0  0
  7  4  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  6  2  1  0  0  0  0
M  END
> <ID>
CHEBI:15901

> <NAME>
5,6-dihydrouracil

> <DEFINITION>
A pyrimidine obtained by formal addition of hydrogen across the 5,6-position of uracil.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:1999; CHEBI:42107; CHEBI:921; CHEBI:19360; CHEBI:20511; CHEBI:12078; CHEBI:28622

> <SYNONYM>
Hydrouracil; Dihydrouracile; Dihydrouracil; DIHYDROPYRIMIDINE-2,4(1H,3H)-DIONE; Dihydro-2,4(1H,3H)-pyrimidinedione; 5,6-dihydrouracil; 5,6-Dihydrouracil; 5,6-Dihydro-2,4-dihydroxypyrimidine; 2,4-Dioxotetrahydropyrimidine; 2,4-Dioxotetrahydropyrimidine; 2,4(1H,3H)-Pyrimidinedione, dihydro-

> <IUPAC_NAME>
dihydropyrimidine-2,4(1H,3H)-dione

> <FORMULA>
C4H6N2O2

> <MASS>
114.10272

> <MONOISOTOPIC_MASS>
114.04293

> <CHARGE>
0

> <SMILES>
O=C1CCNC(=O)N1

> <INCHI>
InChI=1S/C4H6N2O2/c7-3-1-2-5-4(8)6-3/h1-2H2,(H2,5,6,7,8)

> <INCHIKEY>
OIVLITBTBDPEFK-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1851498

> <CAS_REGISTRY_NUMBER>
504-07-4

> <REAXYS_REGISTRY_NUMBER>
112496

> <CHEMIDPLUS>
504-07-4

> <KEGG_COMPOUND_ACCESSION>
C00429

> <METACYC_ACCESSION>
DI-H-URACIL

> <NIST_CHEMISTRY_WEBBOOK>
504-07-4

> <PDBECHEM_ACCESSION>
DUC

> <WIKIPEDIA_ACCESSION>
Dihydrouracil

> <PUBMED_CITATION>
15724255; 18619742; 20926004; 22770225

$$$$