Marvin  03180622232D          

  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 C   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
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  2  1  1  0  0  0  0
M  END
> <ID>
CHEBI:27856

> <NAME>
acetamide

> <DEFINITION>
A member of the class of acetamides that results from the formal condensation of acetic acid with ammonia.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:40563; CHEBI:22159; CHEBI:2385

> <SYNONYM>
methanecarboxamide; ethanamide; Ethanamid; Essigsaeureamid; CH3CONH2; Azetamid; acetic acid amide; acetamide; ACETAMIDE; Acetamide; Acetamid

> <IUPAC_NAME>
acetamide

> <FORMULA>
C2H5NO

> <MASS>
59.06724

> <MONOISOTOPIC_MASS>
59.03711

> <CHARGE>
0

> <SMILES>
CC(N)=O

> <INCHI>
InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)

> <INCHIKEY>
DLFVBJFMPXGRIB-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1071207

> <CAS_REGISTRY_NUMBER>
60-35-5

> <GMELIN_REGISTRY_NUMBER>
1500

> <CHEMIDPLUS>
60-35-5

> <DRUGBANK_ACCESSION>
DB02736

> <KEGG_COMPOUND_ACCESSION>
C06244

> <LINCS_ACCESSION>
LSM-37224

> <NIST_CHEMISTRY_WEBBOOK>
60-35-5

> <PDBECHEM_ACCESSION>
ACM

$$$$