LMPR01090054
  LIPID_MAPS_STRUCTURE_DATABASE

 23 23  0  0  0  0  0  0  0  0999 V2000
    6.9833    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9833    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2687    6.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2687    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5543    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2687    7.7226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6977    6.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4121    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1266    6.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8411    6.4851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5556    6.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2701    6.4851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9844    6.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6990    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4134    6.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1279    6.4850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9844    7.7226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1266    7.7226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6977    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4134    7.7226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6977    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    8.1350    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  1  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 11  1  0  0  0  0
 13 12  2  0  0  0  0
 14 13  1  0  0  0  0
 15 14  2  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 14  1  0  0  0  0
 19 10  1  0  0  0  0
 20  2  1  0  0  0  0
 21 16  2  0  0  0  0
 22  2  1  0  0  0  0
 23  7  1  0  0  0  0
M  END
> <LM_ID>
LMPR01090054

> <COMMON_NAME>
all-trans-18-Hydroxyretinoic acid

> <SYSTEMATIC_NAME>
(2E,4E,6E,8E)-9-[2-(hydroxymethyl)-6,6-dimethylcyclohex-1-en-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenoic acid

> <FORMULA>
C20H28O3

> <MASS>
316.20

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
Retinoids [PR0109]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XSJOIRFEYHJNAW-FCKHSPHMSA-N

> <INCHI>
InChI=1S/C20H28O3/c1-15(7-5-8-16(2)13-19(22)23)10-11-18-17(14-21)9-6-12-20(18,3)4/h5,7-8,10-11,13,21H,6,9,12,14H2,1-4H3,(H,22,23)/b8-5+,11-10+,15-7+,16-13+

> <SMILES>
C1(/C=C/C(/C)=C/C=C/C(/C)=C/C(=O)O)=C(CO)CCCC1(C)C

> <KEGG_ID>
C16679

> <HMDB_ID>
HMDB0012452

> <CHEBI_ID>
80657

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6506224

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$