LMFA04030020
  LIPID_MAPS_STRUCTURE_DATABASE

 32 31  0     0  0            999 V2000
   21.0928    2.7043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9932    2.1842    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.0928    3.5368    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1857    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2783    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3706    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4632    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5557    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6482    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7407    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8333    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9256    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0181    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1106    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2032    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2955    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3882    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4806    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5731    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6656    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7581    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8503    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9431    2.1842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0355    2.7042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6878    1.3649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4806    1.2855    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5334    3.5630    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4461    2.4263    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6572    3.1792    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5249    3.1321    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3432    1.5592    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4521    1.7092    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 18 17  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
  9 25  1  6  0  0  0
 18 26  1  1  0  0  0
 19 27  1  6  0  0  0
 24 28  1  0     0  0
 24 29  1  0     0  0
 24 30  1  0     0  0
 23 31  1  0     0  0
 23 32  1  0     0  0
M  ISO  5  28   2  29   2  30   2  31   2  32   2
M  END
> <LM_ID>
LMFA04030020

> <COMMON_NAME>
Resolvin D2-d5

> <SYSTEMATIC_NAME>
7S,16R,17S-trihydroxy-4Z,8E,10Z,12E,14E,19Z-docosahexaenoic-21,21,22,22,22-d5 acid

> <FORMULA>
C22H28D5O5

> <MASS>
381.26

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Docosanoids [FA04]

> <SUB_CLASS>
Resolvin Ds [FA0403]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
RvD2-d5

> <INCHI_KEY>
IKFAUGXNBOBQDM-XNSNRJMHSA-N

> <INCHI>
InChI=1S/C22H32O5/c1-2-3-9-16-20(24)21(25)17-12-7-5-4-6-10-14-19(23)15-11-8-13-18-22(26)27/h3-12,14,17,19-21,23-25H,2,13,15-16,18H2,1H3,(H,26,27)/b6-4-,7-5+,9-3-,11-8-,14-10+,17-12+/t19-,20+,21-/m1/s1/i1D3,2D2

> <SMILES>
C(CC/C=C\C[C@H](O)/C=C/C=C\C=C\C=C\[C@@H](O)[C@@H](O)C/C=C\C([2H])([2H])C([2H])([2H])[2H])(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
11184

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
156593935

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
32630

> <CITATION>
-

$$$$