LMFA08020192
  LIPID_MAPS_STRUCTURE_DATABASE

 17 16  0     0  0            999 V2000
   -0.4309   -0.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4309   -0.7464    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4309    0.7464    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2991   -0.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1677   -0.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0363   -0.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9049   -0.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7735   -0.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7744   -0.7498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7754   -0.7532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7765   -0.7565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7775   -0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7785   -0.7632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2969   -0.2463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1630   -0.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0290   -0.2462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1630   -1.7463    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  3  0  0  0  0
 10 11  1  0  0  0  0
 11 12  3  0  0  0  0
 12 13  1  0  0  0  0
  2 14  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 15 17  1  0     0  0
M  END
> <LM_ID>
LMFA08020192

> <COMMON_NAME>
Neopellitorine A

> <SYSTEMATIC_NAME>
(2E,4E)-N-(2-methylpropyl)undeca-2,4-dien-7,9-diynamide

> <FORMULA>
C15H19NO

> <MASS>
229.15

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl amines [FA0802]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
LFYBJVLJNNOYNG-HULFFUFUSA-N

> <INCHI>
InChI=1S/C15H19NO/c1-4-5-6-7-8-9-10-11-12-15(17)16-13-14(2)3/h9-12,14H,8,13H2,1-3H3,(H,16,17)/b10-9+,12-11+

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0037770

> <CHEBI_ID>
193284

> <ABBREVIATION>
NA 15:6

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
636555

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
72341

> <CITATION>
11730872

$$$$