LMFA07010656
  LIPID_MAPS_STRUCTURE_DATABASE

 28 27  0     0  0            999 V2000
   20.8695   10.5329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.8695    9.7343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6679    9.1103    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9984    9.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1274    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2563    9.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3850    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5140    9.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6428    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7718    9.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9006    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0295    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1583    9.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2873    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4161    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5451    9.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6739    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8028    9.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9316    9.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.2704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9258    7.9089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0547    7.3712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1835    7.9089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6679    7.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5432    7.4399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.4183    7.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7970    7.3712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7970    6.3606    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 24  1  0  0  0  0
  2  4  1  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
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  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
 24 27  1  0  0  0  0
 27 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010656

> <COMMON_NAME>
4-Methyl-3-heptyl linoleate

> <SYSTEMATIC_NAME>
4-Methyl-3-heptyl 9Z,12Z-octadecadienoate

> <FORMULA>
C26H48O2

> <MASS>
392.37

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(5:0(1Et,2Me)/18:2(9Z,12Z))

> <INCHI_KEY>
MYBYIJWCTLITRC-HDXUUTQWSA-N

> <INCHI>
InChI=1S/C26H48O2/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-26(27)28-25(7-3)24(4)22-6-2/h11-12,14-15,24-25H,5-10,13,16-23H2,1-4H3/b12-11-,15-14-

> <SMILES>
O=C(CCCCCCC/C=C\C/C=C\CCCCC)OC(CC)C(C)CCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
WE 26:2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
56936029

> <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>
411755

> <CITATION>
-

$$$$