Marvin  07050709002D          

 10  9  0  0  0  0            999 V2000
    3.2151    0.2063    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5006   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7862    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0717   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3572    0.2063    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3572   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0717    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7862   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5006    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2151   -0.2063    0.0000 N   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
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
M  END
> <ID>
CHEBI:16610

> <NAME>
spermidine

> <DEFINITION>
A triamine that is the 1,5,10-triaza derivative of decane.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:26733; CHEBI:45647; CHEBI:15095; CHEBI:9218; CHEBI:15097; CHEBI:26732

> <SYNONYM>
SPERMIDINE; Spermidine; Spermidin; N-(3-Aminopropyl)-1,4-butane-diamine; 4-azaoctane-1,8-diamine; 4-azaoctamethylenediamine; 1,5,10-triazadecane

> <IUPAC_NAME>
N-(3-aminopropyl)butane-1,4-diamine

> <FORMULA>
C7H19N3

> <MASS>
145.24598

> <MONOISOTOPIC_MASS>
145.15790

> <CHARGE>
0

> <SMILES>
NCCCCNCCCN

> <INCHI>
InChI=1S/C7H19N3/c8-4-1-2-6-10-7-3-5-9/h10H,1-9H2

> <INCHIKEY>
ATHGHQPFGPMSJY-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1698591

> <CAS_REGISTRY_NUMBER>
124-20-9

> <GMELIN_REGISTRY_NUMBER>
454510

> <REAXYS_REGISTRY_NUMBER>
1698591

> <CHEMIDPLUS>
124-20-9

> <DRUGBANK_ACCESSION>
DB03566

> <KEGG_COMPOUND_ACCESSION>
C00315

> <KNAPSACK_ACCESSION>
C00001431

> <LINCS_ACCESSION>
LSM-37075

> <METACYC_ACCESSION>
SPERMIDINE

> <PDBECHEM_ACCESSION>
SPD

> <WIKIPEDIA_ACCESSION>
Spermidine

> <PUBMED_CITATION>
1176793; 19801973; 22770225; 30306826; 516181; 6156039; 7350997

$$$$