LMFA08020323
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0     0  0            999 V2000
   -0.4368   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4368   -0.7565    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4368    0.7565    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3168   -0.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1971   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0774   -0.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9577   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8382   -0.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7186   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5990   -0.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4793   -0.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3596   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2400   -0.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1203   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0007   -0.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8810   -0.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3070   -0.2540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1771   -0.7564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0472   -0.2539    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9559   -1.3342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8344   -1.6356    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  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  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
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
  2 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 18 20  1  0     0  0
 18 21  1  0     0  0
M  END
> <LM_ID>
LMFA08020323

> <COMMON_NAME>
Isobungeanool

> <SYSTEMATIC_NAME>
2'-hydroxy-N-(isobutyl)-tetradeca-2E,4E,8Z,11E-tetraenamide

> <FORMULA>
C18H29NO2

> <MASS>
291.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl amines [FA0802]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HSFPMLIZJAVYHM-NPNWTSAVSA-N

> <INCHI>
InChI=1S/C18H29NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(20)19-16-18(2,3)21/h5-6,8-9,12-15,21H,4,7,10-11,16H2,1-3H3,(H,19,20)/b6-5+,9-8-,13-12+,15-14+

> <SMILES>
C(/C=C/C=C/CC/C=C\C/C=C/CC)(=O)NCC(C)(C)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
NA 18:4;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14135320

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
328401

> <CITATION>
-

$$$$