LMPR01090025
  LIPID_MAPS_STRUCTURE_DATABASE

 23 23  0     0  0            999 V2000
    6.0607    8.8613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    7.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9258    7.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7919    7.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7919    8.8627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9258    9.3614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2827   10.1277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5699   10.1277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6584    9.3629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6584    7.3624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5247    8.8627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3911    9.3629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3911   10.3615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2575    8.8627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1239    9.3629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9903    8.8627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8566    9.3629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8566   10.3615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7230    8.8627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5879    9.3629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4543    8.8613    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5879   10.3615    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9258    6.3607    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
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  5  9  1  0  0  0  0
  4 10  1  0  0  0  0
  9 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
  3 23  1  0  0  0  0
M  END
> <LM_ID>
LMPR01090025

> <COMMON_NAME>
all-trans-4-hydroxyretinoic acid

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H28O3

> <MASS>
316.20

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
Retinoids [PR0109]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KGUMXGDKXYTTEY-FRCNGJHJSA-N

> <INCHI>
InChI=1S/C20H28O3/c1-14(7-6-8-15(2)13-19(22)23)9-10-17-16(3)18(21)11-12-20(17,4)5/h6-10,13,18,21H,11-12H2,1-5H3,(H,22,23)/b8-6+,10-9+,14-7+,15-13+

> <SMILES>
C1C(C)(C)C(/C=C/C(=C/C=C/C(=C/C(=O)O)/C)/C)=C(C)C(O)C1

> <KEGG_ID>
C16677

> <HMDB_ID>
HMDB0006254

> <CHEBI_ID>
63795

> <ABBREVIATION>
-

> <CAYMAN_ID>
21378

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6438629

> <LIPIDBANK_ID>
VVA0024

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
10029

> <CITATION>
435468

$$$$