LMPR01070151
  LIPID_MAPS_STRUCTURE_DATABASE

 44 43  0     0  0            999 V2000
    6.7133    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5795    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4459    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3120    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1782    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0446    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9108    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7769    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6432    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5095    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3756    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2419    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1082    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9743    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8406    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7068    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5731    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4392    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3055    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1717    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0379    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.9042    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7704    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6367    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.5029    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.3691    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.2353    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.1017    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.9678    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.8340    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.7004    7.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0446    9.2180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5095    9.2180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9743    9.2180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3055    6.7133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7704    6.7133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.2353    6.7133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.5665    8.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5795    9.2180    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.7004    6.7133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7133    8.7171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.5561    7.2212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4459    6.7271    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7239    9.7120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  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
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 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
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
  6 32  1  0  0  0  0
 10 33  1  0  0  0  0
 14 34  1  0  0  0  0
 19 35  1  0  0  0  0
 23 36  1  0  0  0  0
 27 37  1  0  0  0  0
 31 38  1  0  0  0  0
  2 39  1  0  0  0  0
 31 40  1  0  0  0  0
  2 41  1  0  0  0  0
 31 42  1  0  0  0  0
  3 43  2  0  0  0  0
 39 44  1  0  0  0  0
M  END
> <LM_ID>
LMPR01070151

> <COMMON_NAME>
OH-Spheroidenone

> <SYSTEMATIC_NAME>
1'-Hydroxy-1-methoxy-3,4-didehydro-1,2,1',2',7',8'-hexahydro-psi,psi-caroten-2-one

> <FORMULA>
C41H60O3

> <MASS>
600.45

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RUIGAJAIJJUKFM-PZWPVEARSA-N

> <INCHI>
InChI=1S/C41H60O3/c1-33(21-14-23-35(3)25-16-27-37(5)29-18-32-40(7,8)43)19-12-13-20-34(2)22-15-24-36(4)26-17-28-38(6)30-31-39(42)41(9,10)44-11/h12-15,17,19-24,26-28,30-31,43H,16,18,25,29,32H2,1-11H3/b13-12+,21-14+,22-15+,26-17+,31-30+,33-19+,34-20+,35-23+,36-24+,37-27+,38-28+

> <SMILES>
CC(C)(OC)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)/CCCC(C)(O)C

> <KEGG_ID>
C15905

> <HMDB_ID>
-

> <CHEBI_ID>
80164

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
16061267

> <LIPIDBANK_ID>
VCA1069

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1063

> <CITATION>
-

$$$$