LMST01031220
  LIPID_MAPS_STRUCTURE_DATABASE

 41 44  0     0  0            999 V2000
    8.9306   -4.6691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8127   -5.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8127   -6.1968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9306   -6.7061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0487   -6.1968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0487   -5.1784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6948   -4.6691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5769   -5.1783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5769   -6.1968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6948   -6.7061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6947   -3.6505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5768   -3.1414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4588   -3.6505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4588   -4.6691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3408   -3.1413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2228   -3.6504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2229   -4.6689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3408   -2.1226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2227   -1.6135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4587   -1.6136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1048   -2.1225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9868   -1.6134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8689   -2.1224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8689   -3.1411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7508   -1.6133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6948   -5.3055    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8127   -7.2154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5639   -4.4183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6948   -7.7246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1667   -6.7061    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9016   -4.1637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5474   -2.6359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4841   -5.3253    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8277   -3.1500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8277   -2.1488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9606   -1.6482    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6947   -1.6482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9868   -0.6134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1048   -3.1225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5996   -1.1567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8925   -0.4496    0.0000 O   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  1  0     0  0
  5  6  1  0     0  0
  6  1  1  0     0  0
  2  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  3  1  0     0  0
  7 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14  8  1  0     0  0
 13 15  1  0     0  0
 15 16  2  0     0  0
 16 17  1  0     0  0
 14 17  1  0     0  0
 15 18  1  0     0  0
 18 19  1  0     0  0
 18 20  1  1     0  0
 19 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 23 25  1  0     0  0
  7 26  1  6     0  0
  3 27  1  6     0  0
  8 28  1  1     0  0
 10 29  1  1     0  0
  5 30  1  1     0  0
  2 31  1  1     0  0
 13 32  1  1     0  0
 14 33  1  6     0  0
 11 34  1  6     0  0
 34 35  1  0     0  0
 35 36  2  0     0  0
 35 37  1  0     0  0
 22 38  1  6     0  0
 21 39  1  6     0  0
 18 40  1  6     0  0
 40 41  1  0     0  0
M  END
> <LM_ID>
LMST01031220

> <COMMON_NAME>
Lobophysterol B

> <SYSTEMATIC_NAME>
20R-hydroperoxy,11alpha-acetoxy-23R-methyl-ergosta-16-en-3beta,5alpha,6beta-triol

> <FORMULA>
C31H52O7

> <MASS>
536.37

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Ergosterols and C24-methyl derivatives [ST0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171120456

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01031220

$$$$