LMPR01080016
  LIPID_MAPS_STRUCTURE_DATABASE

 45 45  0     0  0            999 V2000
    4.0349  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0349  -12.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8862  -12.7683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7875  -12.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7875  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8862  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6388  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5401  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3914  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2426  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1440  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9951  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8464  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7477  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5989  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4502  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3515  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2028  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0540  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9553  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8065  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6578  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3855   -9.9142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3869   -9.9142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6388  -12.7683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5591  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4104  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6578  -12.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2028  -12.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3914   -9.7639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8464   -9.7639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2615  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1630  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0141  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1630  -12.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.8654  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7167  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.5678  -11.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.4191  -10.7654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.5678  -12.2676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1667  -10.7899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2997  -11.2904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4328  -10.7899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5659  -11.2904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4328   -9.7889    0.0000 C   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  2  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  1  6  1  0     0  0
  5  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
 18 19  1  0     0  0
 19 20  2  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
  6 23  1  0     0  0
  6 24  1  0     0  0
  4 25  1  0     0  0
 22 26  1  0     0  0
 26 27  2  0     0  0
 22 28  1  0     0  0
 18 29  1  0     0  0
  9 30  1  0     0  0
 13 31  1  0     0  0
 27 32  1  0     0  0
 32 33  2  0     0  0
 33 34  1  0     0  0
 33 35  1  0     0  0
 34 36  1  0     0  0
 36 37  1  0     0  0
 37 38  2  0     0  0
 38 39  1  0     0  0
 38 40  1  0     0  0
  1 41  1  0     0  0
 41 42  1  0     0  0
 42 43  2  0     0  0
 43 44  1  0     0  0
 43 45  1  0     0  0
M  END
> <LM_ID>
LMPR01080016

> <COMMON_NAME>
Nonaprene

> <SYSTEMATIC_NAME>
2-(3-Methylbut-2-enyl)-epsilon,psi-carotene

> <FORMULA>
C45H64

> <MASS>
604.50

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
Polyterpenes [PR0108]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DFDWGGSDLBSJMW-LXKGNRKPSA-N

> <INCHI>
InChI=1S/C45H64/c1-35(2)19-15-22-39(7)25-17-27-40(8)26-16-23-37(5)20-13-14-21-38(6)24-18-28-41(9)30-34-44-42(10)31-33-43(45(44,11)12)32-29-36(3)4/h13-14,16-21,23-31,34,43-44H,15,22,32-33H2,1-12H3/b14-13+,23-16+,24-18+,27-17+,34-30+,37-20+,38-21+,39-25+,40-26+,41-28+

> <SMILES>
C1(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=C/C=C(\C)/CC/C=C(\C)/C)C(C)=CC1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10167700

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1718

> <CITATION>
11511870

$$$$