LMPR01070427
  LIPID_MAPS_STRUCTURE_DATABASE

 42 41  0     0  0            999 V2000
   10.1055   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9517   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8475   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6936   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5399   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4358   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2818   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1280   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0239   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8701   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7162   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6121   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4583   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3044   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1505   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0464   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8926   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.7387   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6936   -8.4545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1280   -8.4545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4583  -10.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8926  -10.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2594   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3634   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5173   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6711   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7752   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2594   -8.4545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7752   -8.4545    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.5849   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.4808   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.3269   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.1731   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0690   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.9151   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.7612   -9.9476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.6571   -9.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.3269  -10.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.7612  -10.9431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7797   -9.9975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6838  -10.9665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9097   -8.9502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  7  2  0     0  0
  7  8  1  0     0  0
  8  9  2  0     0  0
  9 10  1  0     0  0
 10 11  2  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 17  2  0     0  0
 17 18  1  0     0  0
  4 19  1  0     0  0
  8 20  1  0     0  0
 13 21  1  0     0  0
 17 22  1  0     0  0
  1 23  2  0     0  0
 23 24  1  0     0  0
 24 25  2  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 23 28  1  0     0  0
 27 29  1  0     0  0
 18 30  2  0     0  0
 30 31  1  0     0  0
 31 32  2  0     0  0
 32 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  2  0     0  0
 36 37  1  0     0  0
 32 38  1  0     0  0
 36 39  1  0     0  0
 27 40  1  0     0  0
 26 41  1  0     0  0
 27 42  1  0     0  0
M  END
> <LM_ID>
LMPR01070427

> <COMMON_NAME>
1,2-Dihydroxy-3,4-didehydrolycopene

> <SYSTEMATIC_NAME>
3,4-Didehydro-1,2-dihydro-psi,psi-carotene-1,2-diol

> <FORMULA>
C40H56O2

> <MASS>
568.43

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DBXCVRBPPRBFRM-PLKLGRONSA-N

> <INCHI>
InChI=1S/C40H56O2/c1-32(2)18-13-21-35(5)24-16-27-36(6)25-14-22-33(3)19-11-12-20-34(4)23-15-26-37(7)28-17-29-38(8)30-31-39(41)40(9,10)42/h11-12,14-20,22-31,39,41-42H,13,21H2,1-10H3/b12-11+,22-14+,23-15+,27-16+,28-17+,31-30+,33-19+,34-20+,35-24+,36-25+,37-26+,38-29+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
87443694

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
51

> <CITATION>
-

$$$$