LMFA02040133
  LIPID_MAPS_STRUCTURE_DATABASE

 26 26  0     0  0            999 V2000
   18.3771   -6.5879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3160   -6.0457    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3771   -7.2971    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.4312   -6.0459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4849   -6.5881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5387   -6.0459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5924   -6.5881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6461   -6.0459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6998   -6.5881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7536   -6.0459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8073   -6.5881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8610   -6.9344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8610   -7.8808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8074   -8.0912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7538   -8.4856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6998   -7.9516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6461   -8.4773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5924   -7.9516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5387   -8.4773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4849   -7.9516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3200   -7.3396    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5444   -5.5857    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1382   -6.6371    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5446   -8.9634    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7538   -9.2656    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5924   -7.1628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 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  2  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 11 21  1  0     0  0
 21 14  1  0     0  0
 11 22  1  6     0  0
 12 23  1  6     0  0
 14 24  1  6     0  0
 15 25  1  6     0  0
 18 26  1  0     0  0
M  END
> <LM_ID>
LMFA02040133

> <COMMON_NAME>
ent16-(R,S)-13-epi-ST-delta14-9-PhytoF

> <SYSTEMATIC_NAME>
8-((2R,3S,5R)-5-((1S,4,E)-1,4-dihydroxyhex-2-en-1-yl)-3-hydroxytetrahydrofuran-2-yl)octanoic acid

> <FORMULA>
C18H32O6

> <MASS>
344.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Phytofurans [FA0204]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(10S,13S,16)-d14-9-PhytoF[9R,12R]

> <INCHI_KEY>
XSSRKBRTVPNAMX-PTZPOEMYSA-N

> <INCHI>
InChI=1S/C18H32O6/c1-2-13(19)10-11-14(20)17-12-15(21)16(24-17)8-6-4-3-5-7-9-18(22)23/h10-11,13-17,19-21H,2-9,12H2,1H3,(H,22,23)/b11-10+/t13?,14-,15-,16+,17+/m0/s1

> <SMILES>
C(CCCCCCC[C@@]1([H])O[C@@]([H])([C@@H](O)/C=C/C(O)CC)C[C@@H]1O)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:2;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
122215868

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
-

$$$$