LMFA08020457
  LIPID_MAPS_STRUCTURE_DATABASE

 32 31  0  0  0  0  0  0  0  0999 V2000
   18.3438   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2260   -4.1290    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.3438   -2.6010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.4550   -4.1290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5659   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7768   -4.1040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7877   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8986   -4.1290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0095   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1204   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2313   -4.1290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3421   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4530   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5639   -4.1290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6748   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7857   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8966   -4.1290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0075   -3.6198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0920   -3.6290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9580   -4.1289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8240   -3.6289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3997   -5.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7032   -5.7190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6901   -4.1288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5561   -3.6288    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   24.4221   -4.1287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5560   -2.6288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7635   -5.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0221   -6.0155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0824   -5.6736    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.3164   -6.3164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9087   -4.6888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  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  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
  2 19  1  0     0  0
  2 22  1  0     0  0
 22 23  1  0     0  0
 21 24  1  0     0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
 25 27  1  0     0  0
 23 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 30 32  1  0     0  0
M  END
> <LM_ID>
LMFA08020457

> <COMMON_NAME>
C16:3(7Z,10Z,13Z)-solamine

> <SYSTEMATIC_NAME>
N,N-bis[3-(dimethylamino)butyl]hexadeca-7Z,10Z,13Z-trienamide

> <FORMULA>
C28H53N3O

> <MASS>
447.42

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl amines [FA0802]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GLBMDJBDZBIYAN-JPFHKJGASA-N

> <INCHI>
InChI=1S/C28H53N3O/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28(32)31(26-21-19-24-29(2)3)27-22-20-25-30(4)5/h7-8,10-11,13-14H,6,9,12,15-27H2,1-5H3/b8-7-,11-10-,14-13-

> <SMILES>
C(CCCCC/C=C\C/C=C\C/C=C\CC)(=O)N(CCCCN(C)C)CCCCN(C)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
178328690

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
147425

> <CITATION>
40413644

$$$$