LMFA07040205
  LIPID_MAPS_STRUCTURE_DATABASE

 23 23  0     0  0            999 V2000
  -11.0410   -6.8578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5390   -5.9954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5390   -7.7202    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0397   -6.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5397   -5.9947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5394   -5.9946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0393   -5.1282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0391   -6.8609    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5396   -4.2621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5399   -4.2622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0400   -3.3959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1977   -3.3222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0403   -3.3960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5405   -4.2623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5407   -4.2624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0408   -5.1287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5405   -5.9950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0406   -6.8613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9472   -7.2841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.7666   -6.7104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6732   -7.1332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.4926   -6.5596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0393   -5.1280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  6  8  1  6     0  0
  7  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 10 12  1  6     0  0
 11 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
 17  2  1  6     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
  7 23  1  6     0  0
M  END
> <LM_ID>
LMFA07040205

> <COMMON_NAME>
Gliomasolide D

> <SYSTEMATIC_NAME>
4R,5S,7R-trihydroxy-2E-octadecen-13R-olide

> <FORMULA>
C18H32O5

> <MASS>
328.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(3E,5R,6S,8R,14R)-5,6,8-trihydroxy-14-pentyl-1-oxacyclotetradec-3-en-2-one

> <INCHI_KEY>
LEEBEEPDVOWSDN-CDBVEKOQSA-N

> <INCHI>
InChI=1S/C18H32O5/c1-2-3-5-9-15-10-7-4-6-8-14(19)13-17(21)16(20)11-12-18(22)23-15/h11-12,14-17,19-21H,2-10,13H2,1H3/b12-11+/t14-,15-,16-,17+/m1/s1

> <SMILES>
C1(C=C[C@@H](O)[C@@H](O)C[C@H](O)CCCCC[C@H](O1)CCCCC)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:2;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
50911006

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1777006

> <CITATION>
-

$$$$