LMFA05000693
  LIPID_MAPS_STRUCTURE_DATABASE

 41 40  0     0  0  0  0  0  0999 V2000
   13.2583   -0.5950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1865   -0.5950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301   -0.5950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9904   -0.5950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.1147   -0.5950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.9186   -0.5950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0622   -0.5950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.8468   -0.5950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.4545    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3923    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3205    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5263    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5885    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2583    0.4050    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   20.1865    0.4050    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.6603    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7224    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1244    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7942    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8564    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0526    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5167    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.6506    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9282    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.3827    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9904    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7846    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    0.4050    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.1962    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.2487    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9186    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0622    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.1147    0.4050    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7320    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.9808    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.8468    0.4050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.7128    0.9050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 14  1  1  6  0  0  0
 15  2  1  6  0  0  0
 28  3  1  6  0  0  0
  4 26  2  0  0  0  0
 35  5  1  6  0  0  0
  6 32  2  0  0  0  0
  7 33  2  0  0  0  0
  8 39  2  0  0  0  0
  9 11  1  0  0  0  0
  9 13  1  0  0  0  0
 10 12  1  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 21  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 26  1  0  0  0  0
 19 24  1  0  0  0  0
 20 26  1  0  0  0  0
 21 32  1  0  0  0  0
 22 23  1  0  0  0  0
 22 25  1  0  0  0  0
 23 27  1  0  0  0  0
 24 33  1  0  0  0  0
 25 31  1  0  0  0  0
 27 32  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 29 33  1  0  0  0  0
 30 34  1  0  0  0  0
 31 35  1  0  0  0  0
 34 36  1  0  0  0  0
 35 37  1  0  0  0  0
 36 38  1  0  0  0  0
 37 39  1  0  0  0  0
 38 40  1  0  0  0  0
 39 41  1  0  0  0  0
M  END
> <LM_ID>
LMFA05000693

> <COMMON_NAME>
PM-Toxin A

> <SYSTEMATIC_NAME>
(4R,12R,20R,28R)-4,12,20,28-tetrahydroxytritriacontane-2,10,18,26-tetrone

> <FORMULA>
C33H60O8

> <MASS>
584.43

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty alcohols [FA05]

> <SUB_CLASS>
-

> <CLASS_LEVEL4>
-

> <SYNONYMS>
C08553; AC1L4LG3

> <INCHI_KEY>
RFJUKGGHUDCGDN-QWWQXMGCSA-N

> <INCHI>
InChI=1S/C33H60O8/c1-3-4-8-15-28(36)23-29(37)18-11-6-12-19-32(40)25-33(41)21-14-7-13-20-31(39)24-30(38)17-10-5-9-16-27(35)22-26(2)34/h27-28,31-32,35-36,39-40H,3-25H2,1-2H3/t27-,28-,31-,32-/m1/s1

> <SMILES>
O[C@@H](CC(CCCCC[C@H](CC(CCCCC[C@H](CC(C)=O)O)=O)O)=O)CCCCCC(C[C@@H](CCCCC)O)=O

> <KEGG_ID>
C08553

> <HMDB_ID>
-

> <CHEBI_ID>
7879

> <ABBREVIATION>
FOH 33:4;O7

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
159223

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$