LMPR01070075
  LIPID_MAPS_STRUCTURE_DATABASE

 44 45  0  0  0  0  0  0  0  0999 V2000
   10.4836    8.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1875    8.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7771    8.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8942    8.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5978    8.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3046    8.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0083    8.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7122    8.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4187    8.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1225    8.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8293    8.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5329    8.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7771    9.6448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5978    9.6448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1225    7.6077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2767    8.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9806    8.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9806    7.6077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0733    8.4231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3694    8.0170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6657    7.6077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9618    8.0170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2582    7.6077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2582    6.7983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9618    6.3918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6657    6.7983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3870    8.5776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5369    8.5776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    6.3918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3694    6.3918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1519    9.6878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8558    9.2813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5595    9.6878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5595   10.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8558   10.9065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1519   10.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4483   10.9065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4308    8.7063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4497    8.5776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2634   10.9065    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.6844    8.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3882    9.2356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9618    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8558   11.8305    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  2  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
  3 13  1  0  0  0  0
  5 14  1  0  0  0  0
 10 15  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
  3 19  1  0  0  0  0
 19 20  3  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 21 26  2  0  0  0  0
 22 27  1  0  0  0  0
 22 28  1  0  0  0  0
 24 29  1  1  0  0  0
 26 30  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 31 36  2  0  0  0  0
 36 37  1  0  0  0  0
 32 38  1  0  0  0  0
 32 39  1  0  0  0  0
 34 40  1  1  0  0  0
 17 41  1  0  0  0  0
 41 42  3  0  0  0  0
 25 43  1  6  0  0  0
 35 44  1  6  0  0  0
 42 31  1  0  0  0  0
 12 16  1  0  0  0  0
M  END
> <LM_ID>
LMPR01070075

> <COMMON_NAME>
4,4'-Dihydroxyalloxanthin

> <SYSTEMATIC_NAME>


> <FORMULA>
C40H52O4

> <MASS>
596.39

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C40 isoprenoids (tetraterpenes) [PR0107]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RRFDBXIHLUIYPE-MQHCDVGBSA-N

> <INCHI>
InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-20,35-38,41-44H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,27-15+,28-16+,29-19+,30-20+/t35-,36-,37-,38-/m0/s1

> <SMILES>
C(=C(/C#CC1=C(C)[C@H](O)[C@@H](O)CC1(C)C)\C)\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(\C#CC1=C(C)[C@H](O)[C@@H](O)CC1(C)C)/C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14408311

> <LIPIDBANK_ID>
VCA0073

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$