LMPR01090070
  LIPID_MAPS_STRUCTURE_DATABASE

 22 22  0     0  0            999 V2000
    6.0606    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9265    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7926    6.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7926    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9265    8.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4265    8.9267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4265    8.9267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6587    8.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5247    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3907    8.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2567    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1228    8.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9887    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8548    8.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7209    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5869    8.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6587    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4529    7.5606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3907    9.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8548    9.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9265    5.0606    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  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  1  0  0  0
  6  8  1  6  0  0  0
  9  5  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
 15 14  1  0  0  0  0
 16 15  2  0  0  0  0
 17 16  1  0  0  0  0
  4 18  1  0  0  0  0
 17 19  1  0  0  0  0
 11 20  1  0  0  0  0
 15 21  1  0  0  0  0
  3 22  1  0     0  0
M  END
> <LM_ID>
LMPR01090070

> <COMMON_NAME>
4-hydroxy-retinol

> <SYSTEMATIC_NAME>
3-[(1E,3E,5E,7E)-9-hydroxy-3,7-dimethylnona-1,3,5,7-tetraenyl]-2,4,4-trimethylcyclohex-2-en-1-ol

> <FORMULA>
C20H30O2

> <MASS>
302.22

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
Retinoids [PR0109]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
IOELQUUUYMBPSA-RMWYGNQTSA-N

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

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
132259

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6080476

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
10116

> <CITATION>
15680170

$$$$