LMFA07010815
  LIPID_MAPS_STRUCTURE_DATABASE

 21 21  0  0  0  0            999 V2000
   -3.5712    1.2369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5712    0.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2859    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8566    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1419    0.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4272    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4272   -0.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7126   -1.2369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1419   -1.2369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7166    0.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7166    1.2369    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4314    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1460    0.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8607    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8607   -0.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5739   -1.2369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2859   -0.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2859    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5739    0.4109    0.0000 C   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
  2  4  2  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
  7 11  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 21  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
M  END
> <LM_ID>
LMFA07010815

> <COMMON_NAME>
Citronellyl cinnamate

> <SYSTEMATIC_NAME>
3,7-dimethyloct-6-en-1-yl (2E)-3-phenylprop-2-enoate

> <FORMULA>
C19H26O2

> <MASS>
286.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KMXKQELDKDGFRN-OUKQBFOZSA-N

> <INCHI>
InChI=1S/C19H26O2/c1-16(2)8-7-9-17(3)14-15-21-19(20)13-12-18-10-5-4-6-11-18/h4-6,8,10-13,17H,7,9,14-15H2,1-3H3/b13-12+

> <SMILES>
C/C(=C\CCC(C)CCOC(/C=C/C1C=CC=CC=1)=O)/C

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0038957

> <CHEBI_ID>
196588

> <ABBREVIATION>
WE 19:6

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6437720

> <LIPIDBANK_ID>
-

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

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

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Branched fatty acids [FA0102]; Carbocyclic fatty acids [FA0114]

> <ALT_CLASS_LEVEL4S>
-; -; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$