LMFA05000735
  LIPID_MAPS_STRUCTURE_DATABASE

 35 34  0     0  0            999 V2000
    0.4979   -3.7683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9972   -4.6330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5062   -3.7650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5107   -3.7617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5151   -3.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5196   -3.7550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5241   -3.7516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5285   -3.7483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5330   -3.7449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4046   -3.2457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2761   -3.7449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  -12.6340   -3.2457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5055   -2.7464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  -19.6065   -2.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  -23.0927   -2.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -23.9643   -2.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -24.8359   -2.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -25.7074   -2.2471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -26.5790   -2.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -27.4506   -3.2456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5330   -4.7436    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -25.7074   -1.2484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  3  0  0  0  0
  4  5  1  0  0  0  0
  5  6  3  0  0  0  0
  6  7  1  0  0  0  0
  7  8  3  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
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 16 17  3  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  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  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  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  3  0  0  0  0
  9 34  1  1  0  0  0
 31 35  1  6  0  0  0
M  END
> <LM_ID>
LMFA05000735

> <COMMON_NAME>
Triangulyne E

> <SYSTEMATIC_NAME>
Dotriaconta-17,28-dien-2,4,6,15,31-pentayne-1,8,30-triol

> <FORMULA>
C32H42O3

> <MASS>
474.31

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty alcohols [FA05]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CVOHSXPVNKSLMG-HGMDRNRHSA-N

> <INCHI>
InChI=1S/C32H42O3/c1-2-31(34)27-23-19-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-20-24-28-32(35)29-25-21-18-22-26-30-33/h1,5,7,23,27,31-35H,3-4,6,8,10,12-17,19-20,24,28,30H2/b7-5-,27-23+/t31-,32-/m0/s1

> <SMILES>
C(C#CC#CC#C[C@@H](O)CCCCCCC#C/C=C\CCCCCCCCC/C=C/[C@@H](O)C#C)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FOH 32:12;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5469814

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
283402

> <CITATION>
8991958

$$$$