Marvin  11070608572D          

  4  3  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 C   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 O   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
  4  1  1  0  0  0  0
  3  1  2  0  0  0  0
  2  1  1  0  0  0  0
M  END
> <ID>
CHEBI:16199

> <NAME>
urea

> <DEFINITION>
A carbonyl group with two C-bound amine groups. The commercially available fertilizer has an analysis of 46-0-0 (N-P2O5-K2O).

> <STAR>
3

> <SECONDARY_ID>
CHEBI:46379; CHEBI:9888; CHEBI:15292; CHEBI:27218

> <SYNONYM>
uree; urea; UREA; Urea; ur; Karbamid; Harnstoff; H2NC(O)NH2; E927b; carbonyldiamide; Carbamide; 1728

> <IUPAC_NAME>
urea

> <INN>
carbamide

> <FORMULA>
CH4N2O

> <MASS>
60.05534

> <MONOISOTOPIC_MASS>
60.03236

> <CHARGE>
0

> <SMILES>
NC(N)=O

> <INCHI>
InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)

> <INCHIKEY>
XSQUKJJJFZCRTK-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
635724

> <CAS_REGISTRY_NUMBER>
57-13-6

> <GMELIN_REGISTRY_NUMBER>
1378

> <REAXYS_REGISTRY_NUMBER>
635724

> <CHEMIDPLUS>
57-13-6

> <DRUGBANK_ACCESSION>
DB03904

> <ECMDB_ACCESSION>
ECMDB04172

> <KEGG_COMPOUND_ACCESSION>
C00086

> <KEGG_DRUG_ACCESSION>
D00023

> <KNAPSACK_ACCESSION>
C00007314

> <METACYC_ACCESSION>
UREA

> <NIST_CHEMISTRY_WEBBOOK>
57-13-6

> <PDBECHEM_ACCESSION>
URE

> <WIKIPEDIA_ACCESSION>
Urea

> <YMDB_ACCESSION>
YMDB00003

> <PUBMED_CITATION>
18037357; 22770225

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