LMPR01070424
  LIPID_MAPS_STRUCTURE_DATABASE

 41 40  0     0  0            999 V2000
    6.0142   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8609   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7571   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6037   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4503   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3467   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1932   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0398   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9362   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7828   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6294   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5257   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3723   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2189   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0654   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9618   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8083   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6549   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6037   -7.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0398   -7.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3723  -10.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8083  -10.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1677   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2712   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4247   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5782   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6818   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1677   -7.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6818   -7.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5015   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3978   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2444   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0910   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.9874   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.8340   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6805   -9.3833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.5769   -8.8854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2444  -10.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6805  -10.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6858   -9.4332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1682   -8.9162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  7  1  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  1  0     0  0
 25 26  1  0     0  0
 26 27  2  0     0  0
 23 28  1  0     0  0
 27 29  1  0     0  0
 18 30  1  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
 40 41  1  0     0  0
M  END
> <LM_ID>
LMPR01070424

> <COMMON_NAME>
Phytofluenol

> <SYSTEMATIC_NAME>
7,8,11,12,7',8'-Hexahydro-psi,psi-caroten-16-ol

> <FORMULA>
C40H62O

> <MASS>
558.48

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OOXRSLOSLOFFJR-LONZTZLASA-N

> <INCHI>
InChI=1S/C40H62O/c1-33(2)18-12-21-36(5)24-15-27-37(6)25-13-22-34(3)19-10-11-20-35(4)23-14-26-38(7)28-16-29-39(8)30-17-31-40(9)32-41/h10-11,13,18-20,22,24-26,29,31,41H,12,14-17,21,23,27-28,30,32H2,1-9H3/b11-10+,22-13+,34-19+,35-20+,36-24+,37-25+,38-26+,39-29+,40-31+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
87443413

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
4081; 1280

> <CITATION>
5423369

$$$$