LMPR01090069
  LIPID_MAPS_STRUCTURE_DATABASE

 22 22  0     0  0            999 V2000
    4.7856    1.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7856    0.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6515   -0.1894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5176    0.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5176    1.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6515    1.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1515    2.6767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3837    1.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2497    1.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1157    1.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9817    1.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8478    1.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7137    1.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5798    1.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3119    1.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3837   -0.1894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1779    1.3106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1157    2.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5798    2.8106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4459    1.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1515    2.6767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4459    0.3106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  6  0  0  0
  8  5  2  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
 13 12  1  0  0  0  0
 14 13  2  0  0  0  0
  4 16  1  0  0  0  0
 15 17  1  0  0  0  0
 10 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 20 14  1  0  0  0  0
  6 21  1  1  0  0  0
 20 22  1  0     0  0
M  END
> <LM_ID>
LMPR01090069

> <COMMON_NAME>
14-Hydroxy-retro-retinol

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H30O2

> <MASS>
302.22

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
Retinoids [PR0109]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PCRZONNRANOQPA-XRKJSDEASA-N

> <INCHI>
InChI=1S/C20H30O2/c1-15(8-6-9-17(3)19(22)14-21)11-12-18-16(2)10-7-13-20(18,4)5/h6,8-12,19,21-22H,7,13-14H2,1-5H3/b8-6+,15-11+,17-9+,18-12+

> <SMILES>
C1[C@](C)(C)/C(=C/C=C(\C)/C=C/C=C(/C(O)CO)\C)/C(C)=CC1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6510267

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
10090

> <CITATION>
8652644

$$$$