LMFA07010582
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0     0  0            999 V2000
   17.2845    9.1943    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2845    8.4029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0760    7.7845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0760    6.6296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4212    7.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5579    8.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6945    7.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8311    8.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9677    7.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1044    8.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2410    7.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3776    8.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5142    7.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6508    8.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7875    7.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9241    8.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    7.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2127    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3493    6.5936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4859    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3493    7.5829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  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  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
  4 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010582

> <COMMON_NAME>
3-Methyl-3-butenyl tetradecanoate

> <SYSTEMATIC_NAME>
3-Methyl-3-butenyl tetradecanoate

> <FORMULA>
C19H38O2

> <MASS>
298.29

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(4:1(3)(3Me)/14:0)

> <INCHI_KEY>
AISCBZKHUSXEOC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H38O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-19(20)21-17-16-18(2)3/h18H,4-17H2,1-3H3

> <SMILES>
O=C(CCCCCCCCCCCCC)OCCC(C)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179621

> <ABBREVIATION>
WE 19:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
95950

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
926293

> <CITATION>
24254630

$$$$