LMGL03013680
  LIPID_MAPS_STRUCTURE_DATABASE

 55 54  0  0  0  0  0  0  0  0999 V2000
   16.4450    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7333    6.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0219    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3103    6.9452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5989    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5989    8.1772    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1445    6.2337    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3221    6.2337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6106    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6106    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8993    6.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8874    6.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4450    8.1765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0259    8.7685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0259    9.5791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7374    8.3466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1823    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4653    6.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7482    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0312    6.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3141    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5971    6.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8800    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1630    6.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4459    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7289    6.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0118    5.8225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2948    6.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1705    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4534    6.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7364    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0193    6.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3023    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5852    6.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8682    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1511    6.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4341    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7170    6.9452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3094    9.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5924    9.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8753    9.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1583    9.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4412    9.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7242    9.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0071    9.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2901    9.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5730    9.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8560    9.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1390    9.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4219    9.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7049    9.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9878    9.5792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2708    9.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5537    9.5792    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  8  1  6  0  0  0
  2  7  1  1  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 12  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
  1 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 11 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
 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
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 12 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 15 40  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 43 44  1  0  0  0  0
 44 45  1  0  0  0  0
 45 46  1  0  0  0  0
 46 47  1  0  0  0  0
 47 48  1  0  0  0  0
 48 49  1  0  0  0  0
 49 50  1  0  0  0  0
 50 51  1  0  0  0  0
 51 52  1  0  0  0  0
 52 53  1  0  0  0  0
 53 54  1  0  0  0  0
 54 55  1  0  0  0  0
M  END
> <LM_ID>
LMGL03013680

> <COMMON_NAME>
TG 13:0/14:0/18:0 [iso6]

> <SYSTEMATIC_NAME>
1-tridecanoyl-2-tetradecanoyl-3-octadecanoyl-sn-glycerol

> <FORMULA>
C48H92O6

> <MASS>
764.69

> <CATEGORY>
Glycerolipids [GL]

> <MAIN_CLASS>
Triradylglycerols [GL03]

> <SUB_CLASS>
Triacylglycerols [GL0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
TG(45:0); TG(13:0_14:0_18:0)

> <INCHI_KEY>
KNQVTQAJWRSOCN-WBVITSLISA-N

> <INCHI>
InChI=1S/C48H92O6/c1-4-7-10-13-16-19-22-23-24-25-27-29-32-35-38-41-47(50)53-44-45(43-52-46(49)40-37-34-31-28-21-18-15-12-9-6-3)54-48(51)42-39-36-33-30-26-20-17-14-11-8-5-2/h45H,4-44H2,1-3H3/t45-/m1/s1

> <SMILES>
C(OC(=O)CCCCCCCCCCCCCCCCC)[C@]([H])(OC(CCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCC)=O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0108251

> <CHEBI_ID>
-

> <ABBREVIATION>
TG 45:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000130072

> <PUBCHEM_COMPOUND_ID>
56937470

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$