LMPR01071058
  LIPID_MAPS_STRUCTURE_DATABASE

 33 32  0     0  0            999 V2000
    1.6300  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5270  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3741  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2213  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1183  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9654  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8624  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7594  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6066  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4537  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3507  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1979  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0450  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9420  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7892  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6364  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5333  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3805  -16.1752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6364  -17.1718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1979  -17.1718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3741  -14.6802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8624  -14.6802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2276  -15.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7596  -16.1757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1065  -15.6757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9726  -16.1757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8386  -15.6757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7047  -16.1757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1065  -14.6758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5906  -15.6757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4567  -16.1757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5955  -14.6759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0963  -16.1690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  5  6  2  0     0  0
  6  7  1  0     0  0
  7  8  2  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
 10 11  1  0     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 17  1  0     0  0
 17 18  2  0     0  0
 16 19  1  0     0  0
 12 20  1  0     0  0
  3 21  1  0     0  0
  7 22  1  0     0  0
 18 23  1  0     0  0
  1 24  1  0     0  0
 24 25  2  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 25 29  1  0     0  0
 28 30  2  0     0  0
 30 31  1  0     0  0
 30 32  1  0     0  0
 23 33  2  0     0  0
M  END
> <LM_ID>
LMPR01071058

> <COMMON_NAME>
Apo-6'-lycopenal

> <SYSTEMATIC_NAME>
6'-Apo-psi-caroten-6'-al

> <FORMULA>
C32H42O

> <MASS>
442.32

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Apo-2-lycopenal

> <INCHI_KEY>
ZXEPHOYZDSLBJV-CQOAVJQGSA-N

> <INCHI>
InChI=1S/C32H42O/c1-27(2)15-10-18-30(5)21-13-23-31(6)22-11-19-28(3)16-8-9-17-29(4)20-12-24-32(7)25-14-26-33/h8-9,11-17,19-26H,10,18H2,1-7H3/b9-8+,19-11+,20-12+,23-13+,25-14+,28-16+,29-17+,30-21+,31-22+,32-24+

> <SMILES>
C(/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=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
176126

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
20055192

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
4081; 9606

> <CITATION>
20178389

$$$$