LMFA04050007
  LIPID_MAPS_STRUCTURE_DATABASE

 32 31  0     0  0            999 V2000
    9.4049   -3.2762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3120   -2.7524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4049   -4.3239    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4908   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5764   -3.2762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6620   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7477   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8333   -3.2762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9189   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0045   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0901   -3.2762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6529   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.1392   -3.2762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0536   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9680   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8824   -3.2762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7969   -2.7524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5673   -4.3239    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4816   -1.7047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5577   -4.2673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2082   -4.7093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7396   -4.7093    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2082   -5.5935    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9738   -4.2673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9738   -3.5775    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  2  0     0  0
 12 13  1  0     0  0
 13 14  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  2  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
 15 25  1  1     0  0
 16 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>
LMFA04050007

> <COMMON_NAME>
MCTR3

> <SYSTEMATIC_NAME>
13R-(S-cysteinyl)-14S-hydroxy-4Z,7Z,9E,11E,16Z,19Z-docosahexaenoic acid

> <FORMULA>
C25H37NO5S

> <MASS>
463.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Maresins [FA0405]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
13-cysteinyl-maresin 2; Maresin Conjugates in Tissue Regeneration 3; Maresin Sulfido Conjugate 3

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
138209

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
122368873

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA04050007

$$$$