Marvin  05250818042D          

  7  6  0  0  0  0            999 V2000
   -2.1434    0.1768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -0.2357    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    0.1768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.2357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.1768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -0.2357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    0.1768    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
M  END
> <ID>
CHEBI:17166

> <NAME>
N-methylputrescine

> <DEFINITION>
An N-monosubstituted putrescine where the N-substituent is methyl.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:7323; CHEBI:12610; CHEBI:21771

> <SYNONYM>
N-Methylputrescine

> <IUPAC_NAME>
N-methylbutane-1,4-diamine

> <FORMULA>
C5H14N2

> <MASS>
102.17814

> <MONOISOTOPIC_MASS>
102.11570

> <CHARGE>
0

> <SMILES>
CNCCCCN

> <INCHI>
InChI=1S/C5H14N2/c1-7-5-3-2-4-6/h7H,2-6H2,1H3

> <INCHIKEY>
RMIVMBYMDISYFZ-UHFFFAOYSA-N

> <KEGG_COMPOUND_ACCESSION>
C02723

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