LMPR01070441
  LIPID_MAPS_STRUCTURE_DATABASE

 43 42  0     0  0            999 V2000
    5.5818  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4281  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3242  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1705  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0167  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9128  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7591  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6053  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5014  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3477  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1940  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0900  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9363  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7826  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6289  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5249  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3712  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2175  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1705   -9.5872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.3712  -12.0762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7356  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8395  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9932  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1470  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2509  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7356   -9.5872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2509   -9.5872    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.0638  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9598  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.8061  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.6524  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5485  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.3947  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.2410  -11.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.1371  -10.5828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.8061  -12.0762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.2410  -12.0762    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2552  -11.1305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3851  -10.0830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.1068  -11.5805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.3642  -12.5822    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  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  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  1  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
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 36 42  1  0     0  0
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M  END
> <LM_ID>
LMPR01070441

> <COMMON_NAME>
1'-Hydroxy-3,4,1',2',11',12'-hexahydrospheroidene

> <SYSTEMATIC_NAME>
1'-Methoxy-1,2,7,8,11,12,1',2'-octahydro-psi,psi-caroten-1-ol

> <FORMULA>
C41H66O2

> <MASS>
590.51

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
URTRBZLSOOJMOH-QAPWXVJQSA-N

> <INCHI>
InChI=1S/C41H66O2/c1-34(22-14-24-36(3)26-16-28-38(5)30-18-32-40(7,8)42)20-12-13-21-35(2)23-15-25-37(4)27-17-29-39(6)31-19-33-41(9,10)43-11/h12-13,15,17,20-21,23-25,27-29,42H,14,16,18-19,22,26,30-33H2,1-11H3/b13-12+,23-15+,27-17+,34-20+,35-21+,36-24+,37-25+,38-28+,39-29+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
87443612

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1085

> <CITATION>
-

$$$$