LMFA07010632
  LIPID_MAPS_STRUCTURE_DATABASE

 25 24  0  0  0  0  0  0  0  0999 V2000
   16.3665    7.6113    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.3665    6.9635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0144    6.4573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0144    5.5119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6599    6.5872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9532    7.0028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2464    6.5872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9532    7.8126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3077    5.0463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6010    5.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8943    5.0463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1875    5.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4808    5.0463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7741    5.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0673    5.0463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3606    5.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6539    5.0463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9471    5.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2404    5.0463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5337    5.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8269    5.0463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1202    5.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4135    5.0463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7067    5.4825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0463    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
  6  8  1  0  0  0  0
  4  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  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010632

> <COMMON_NAME>
9-Octadecenyl 3-methylbutanoate

> <SYSTEMATIC_NAME>
9-Octadecenyl 3-methylbutanoate

> <FORMULA>
C23H44O2

> <MASS>
352.33

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(18:1(9E)/4:0(3Me))

> <INCHI_KEY>
LOCNAPVACGRDIV-VAWYXSNFSA-N

> <INCHI>
InChI=1S/C23H44O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-23(24)21-22(2)3/h11-12,22H,4-10,13-21H2,1-3H3/b12-11+

> <SMILES>
O=C(CC(C)C)OCCCCCCCC/C=C/CCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
WE 23:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
13338913

> <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>
-

> <CITATION>
-

$$$$