LMFA02000317
  LIPID_MAPS_STRUCTURE_DATABASE

 23 22  0     0  0            999 V2000
   -0.4336   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4336   -0.7510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4336    0.7510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3071   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1810   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0550   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9289   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8028   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6767   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5506   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4245   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2985   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1724   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0463   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9202   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7941   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6681   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5420   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4159   -0.7510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.2898   -0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4245    0.7510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2985   -1.7523    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1637   -0.7510    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  1  0     0  0
 13 14  1  0     0  0
 14 15  2  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  0     0  0
 12 22  1  0     0  0
 20 23  1  0     0  0
M  END
> <LM_ID>
LMFA02000317

> <COMMON_NAME>
9,10,18-trihydroxy-12Z-octadecenoic acid

> <SYSTEMATIC_NAME>
9,10,18-trihydroxy-12Z-octadecenoic acid

> <FORMULA>
C18H34O5

> <MASS>
330.24

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Other Octadecanoids [FA0200]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
12-Octadecenoic acid, 9,10,18-trihydroxy-, (12Z)-; 9,10,18-Trihydroxyoctadec-12-enoic acid

> <INCHI_KEY>
NFBTXRAFZLIQAU-YWEYNIOJSA-N

> <INCHI>
InChI=1S/C18H34O5/c19-15-11-7-2-1-4-8-12-16(20)17(21)13-9-5-3-6-10-14-18(22)23/h4,8,16-17,19-21H,1-3,5-7,9-15H2,(H,22,23)/b8-4-

> <SMILES>
C(CCCCCCCC(O)C(O)C/C=C\CCCCCO)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:1;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21159010

> <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>
-

> <CITATION>
-

$$$$