LMFA04040006
  LIPID_MAPS_STRUCTURE_DATABASE

 32 31  0     0  0            999 V2000
   15.3045   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1968   -6.5071    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3045   -8.0526    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4056   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5064   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6070   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7078   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8086   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9094   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0101   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1109   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2116   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3123   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4131   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5138   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6146   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7153   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8161   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9168   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0175   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8817   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7810   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6802   -7.0222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5797   -6.5071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8161   -8.0526    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9168   -5.4768    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9526   -7.9908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7727   -8.4642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4127   -8.4642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7727   -9.4110    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5927   -7.9908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5927   -7.2521    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  2  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  2  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 15  2  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
 20 21  1  0     0  0
 21 22  2  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 18 25  1  1     0  0
 19 26  1  6     0  0
 27 28  1  0     0  0
 28 30  1  1     0  0
 28 31  1  0     0  0
 31 29  1  0     0  0
 31 32  2  0     0  0
 25 27  1  0     0  0
M  END
> <LM_ID>
LMFA04040006

> <COMMON_NAME>
PCTR3

> <SYSTEMATIC_NAME>
16R-(S-cysteinyl)-17S-hydroxy-4Z,7Z,10Z,12E,14E,19Z-docosahexaenoic acid

> <FORMULA>
C25H37NO5S

> <MASS>
463.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Protectins [FA0404]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Protectin Conjugates in Tissue Regeneration 3

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
132562748

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA04040006

$$$$