LMFA02030025
  LIPID_MAPS_STRUCTURE_DATABASE

 22 22  0     0  0            999 V2000
   -0.4311   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4311   -0.7468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4311    0.7468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2998   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1689   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0379   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9070   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7760   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6451   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5141   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3832   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2522   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1213   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9336   -0.8342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8874   -0.5266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4806   -1.3321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8874   -2.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9336   -1.8300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1213   -2.4151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2522   -1.9173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3832    0.7468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1451    0.4328    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  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  2  0     0  0
 13 14  1  0     0  0
 14 18  2  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
 11 21  1  1     0  0
 15 22  2  0     0  0
M  END
> <LM_ID>
LMFA02030025

> <COMMON_NAME>
9-B1-PhytoP

> <SYSTEMATIC_NAME>
(S,E)-11-(2-ethyl-5-oxocyclopent-1-en-1-yl)-9-hydroxyundec-10-enoic acid

> <FORMULA>
C18H28O4

> <MASS>
308.20

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Phytoprostanes [FA0203]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(9S)-9-B1-PhytoP

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
173192

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
131839828

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active (generated by computational methods)

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA02030025

$$$$