LMFA07011140
  LIPID_MAPS_STRUCTURE_DATABASE

 39 38  0     0  0            999 V2000
    1.2873   -1.5243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4246   -1.0301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4248    0.5358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4312    0.0416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4248    1.5243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2873    0.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3060   -1.0301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1735   -1.5243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1542    0.5358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0215    0.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8891    0.5358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7566    0.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6240    0.5358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4916    0.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3591    0.5358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2264    0.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0940    0.5358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9615    0.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8289    0.5358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6965    0.0416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5640    0.5358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1544   -1.0301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0218   -1.5243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8844   -1.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4270    0.0310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2957    0.5259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0364   -1.0193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9052   -1.5142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7681   -1.0093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6368   -1.5042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4998   -0.9992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3685   -1.4941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2314   -0.9892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1002   -1.4840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9631   -0.9791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8319   -1.4740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7532   -1.5143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8786   -0.0197    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  5  4  1  0     0  0
  4  6  2  0     0  0
  4  7  1  0     0  0
  5  2  1  0     0  0
  3  8  1  0     0  0
  8  9  1  0     0  0
  7 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
  1 23  1  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 22 26  1  0     0  0
 26 27  1  0     0  0
  9 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 25 38  1  0     0  0
 25 39  2  0     0  0
M  END
> <LM_ID>
LMFA07090090

> <COMMON_NAME>
FAHFA 17:0/5O(FA 18:0)

> <SYSTEMATIC_NAME>
5-heptadecanoyloxy-octadecanoic acid

> <FORMULA>
C35H68O4

> <MASS>
552.51

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Fatty acid estolides [FA0709]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
5-HDAHSA;5-heptadecanoyloxystearic acid

> <INCHI_KEY>
UHLIJFPLQZAGKS-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C35H68O4/c1-3-5-7-9-11-13-15-16-17-19-21-23-25-27-32-35(38)39-33(30-28-31-34(36)37)29-26-24-22-20-18-14-12-10-8-6-4-2/h33H,3-32H2,1-2H3,(H,36,37)

> <SMILES>
C(CCC(=O)O)C(OC(CCCCCCCCCCCCCCCC)=O)CCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FAHFA 35:0;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101527472

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
10090

> <CITATION>
31988049

$$$$