LMPR01070438
  LIPID_MAPS_STRUCTURE_DATABASE

 42 41  0     0  0            999 V2000
    4.7436  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5905  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4870  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3338  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1806  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0772  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9240  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7708  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6674  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5142  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3610  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2576  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1044  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9512  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7979  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6946  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5413  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3881  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3338   -9.9152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7708   -9.9152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1044  -12.4058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5413  -12.4058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8968  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0002  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1534  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3067  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4100  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8968   -9.9152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4100   -9.9152    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.2350  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1315  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9783  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.8251  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.7218  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5685  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4153  -11.4096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.3119  -10.9115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9783  -12.4058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4153  -12.4058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5862  -11.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4562  -10.4113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2656   -9.4214    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  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  1  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  1  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
 27 41  1  0     0  0
 29 42  1  0     0  0
M  END
> <LM_ID>
LMPR01070438

> <COMMON_NAME>
1-Methoxy-1,2-dihydrophytoene

> <SYSTEMATIC_NAME>
1-Methoxy-1,2,7,8,11,12,7',8',11',12'-decahydro-psi,psi-carotene

> <FORMULA>
C41H68O

> <MASS>
576.53

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BSRLPUSCNDHEKY-HASPIEIKSA-N

> <INCHI>
InChI=1S/C41H68O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,20-22,26-28,31H,14-19,23-25,29-30,32-33H2,1-11H3/b13-12+,35-21+,36-22+,37-26+,38-27+,39-28+,40-31+

> <SMILES>
C(=C(/C)\CCCC(C)(C)OC)/CC/C(/C)=C/CC/C(/C)=C/C=C/C=C(\C)/CC/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>
87443303

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1085

> <CITATION>
-

$$$$