LMPR01070502
  LIPID_MAPS_STRUCTURE_DATABASE

 36 35  0     0  0            999 V2000
   12.2090  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0754  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9420  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8085  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6749  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5416  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4081  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2746  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1411  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0076  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8742  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7407  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6072  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.4738  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3404  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.2067  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.0734  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.9399  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8085  -13.6590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2746  -13.6591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6072  -16.1604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.0734  -16.1604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3423  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4758  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6093  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7428  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8762  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0098  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3423  -13.6591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8762  -13.6592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.7839  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.6504  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.5169  -15.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3834  -14.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.5169  -16.1604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.2499  -15.1599    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  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  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
  4 19  1  0  0  0  0
  8 20  1  0  0  0  0
 13 21  1  0  0  0  0
 17 22  1  0  0  0  0
  1 23  2  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
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 23 29  1  0  0  0  0
 27 30  1  0  0  0  0
 18 31  2  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 33 35  1  0  0  0  0
 34 36  2  0  0  0  0
M  END
> <LM_ID>
LMPR01070502

> <COMMON_NAME>
Apo-4'-lycopenal

> <SYSTEMATIC_NAME>
4'-Apo-psi,psi-caroten-4'-al

> <FORMULA>
C35H46O

> <MASS>
482.35

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QPKNTQUMMSIKLQ-YMWARTTESA-N

> <INCHI>
InChI=1S/C35H46O/c1-29(2)16-11-19-32(5)22-14-25-33(6)23-12-20-30(3)17-9-10-18-31(4)21-13-24-34(7)26-15-27-35(8)28-36/h9-10,12-18,20-28H,11,19H2,1-8H3/b10-9+,20-12+,21-13+,25-14+,26-15+,30-17+,31-18+,32-22+,33-23+,34-24+,35-27+

> <SMILES>
C(=C(/C)\CC/C=C(\C)/C)/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
50986183

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
5141

> <CITATION>
23893079

$$$$