LMFA07011198
  LIPID_MAPS_STRUCTURE_DATABASE

 31 30  0     0  0            999 V2000
   -0.9114   -1.6904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7774   -2.1904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6435   -1.6904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5095   -2.1904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3755   -1.6904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2415   -2.1904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0538   -4.7250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0454   -2.1904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3755   -0.6904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7774   -3.1904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6435   -0.6904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5095   -3.1904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9681   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0749   -4.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1818   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2886   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3954   -4.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5023   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6091   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7159   -4.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8228   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9296   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0364   -4.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1433   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7499   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6431   -4.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5362   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4294   -4.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3226   -4.7175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2154   -3.1825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2154   -4.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  1  8  1  0     0  0
  5  9  1  1     0  0
  2 10  1  1     0  0
  3 11  1  6     0  0
  4 12  1  6     0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  2  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  2  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  2  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 31 29  1  0  0  0  0
 31 30  1  0  0  0  0
  7 31  2  0  0  0  0
  6 30  1  0     0  0
M  END
> <LM_ID>
LMFA07011198

> <COMMON_NAME>
HSN-S1

> <SYSTEMATIC_NAME>
2R,3R,4R,5R,6-pentahydroxyhexyl octadeca-6Z,9Z,12Z,15Z-tetraenoate

> <FORMULA>
C24H40O7

> <MASS>
440.28

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Stearidonoly mannitol

> <INCHI_KEY>
KIZMVIIFEMISGO-ZTAXKTKCSA-N

> <INCHI>
InChI=1S/C24H40O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(28)31-19-21(27)24(30)23(29)20(26)18-25/h3-4,6-7,9-10,12-13,20-21,23-27,29-30H,2,5,8,11,14-19H2,1H3/b4-3-,7-6-,10-9-,13-12-/t20-,21-,23-,24-/m1/s1

> <SMILES>
C(O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\CC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
WE 24:4;O5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
590727

> <CITATION>
39195470

$$$$