LMFA08040070
  LIPID_MAPS_STRUCTURE_DATABASE

 14 13  0     0  0            999 V2000
    2.6939   -7.0010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5561   -6.5032    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6939   -7.9968    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8252   -6.5032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9562   -7.0010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0871   -6.5032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7819   -7.0010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6509   -6.5032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5199   -7.0010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8253   -5.5032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6509   -5.5032    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4221   -7.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2882   -6.5033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1542   -7.0034    0.0000 O   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
  4 10  1  0     0  0
  8 11  2  0     0  0
  2 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
M  END
> <LM_ID>
LMFA08040070

> <COMMON_NAME>
Rehmagluamide

> <SYSTEMATIC_NAME>
N-2-methyl-6-oxo-2E,4E-heptadienoyl-ethanolamine

> <FORMULA>
C10H15NO3

> <MASS>
197.11

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl ethanolamines (endocannabinoids) [FA0804]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(2E,4E)-N-(2-hydroxyethyl)-2-methyl-6-oxohepta-2,4-dienamide

> <INCHI_KEY>
WQCAJGYNYVBEIO-MSLMYCKWSA-N

> <INCHI>
InChI=1S/C10H15NO3/c1-8(4-3-5-9(2)13)10(14)11-6-7-12/h3-5,12H,6-7H2,1-2H3,(H,11,14)/b5-3+,8-4+

> <SMILES>
C(/C(/C)=C/C=C/C(=O)C)(=O)NCCO

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
NAE 8:3;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171121049

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
99300

> <CITATION>
33844616

$$$$