LMST01160050
  LIPID_MAPS_STRUCTURE_DATABASE

 42 48  0     0  0            999 V2000
    9.4811    7.4994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4756    9.5395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5924    9.0244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6014    8.0049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3682    9.0345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3646    8.0140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1310    8.0080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1347    9.0282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2533    9.5449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4811    8.3483    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3682    9.9449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2422   10.5373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1210   11.0362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2422   11.3075    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3646    7.2514    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7235    7.4994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7235    6.4846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6014    5.9789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4811    6.4846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8511    8.0028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9789    7.4994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9789    6.4923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8511    5.9886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7235    8.3079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4646   11.0261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6014    7.2146    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0445   10.4882    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9808   11.0362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9808   12.1095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0445   12.6575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1210   12.1095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6559   10.6139    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7568   12.5529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8511    8.9893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8264    7.3080    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5676    6.3561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2627    5.6561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6138    6.1040    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0415   13.6487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1414   10.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8478    4.9886    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7245    5.4715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  6  1  0  0  0  0
  5  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  6  7  1  0  0  0  0
  1 10  1  1  0  0  0
  5 11  1  1  0  0  0
  9 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  1  0  0  0
  6 15  1  1  0  0  0
  4 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19  1  1  0  0  0  0
 16 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 17  1  0  0  0  0
 16 24  1  1  0  0  0
 12 25  1  6  0  0  0
  4 26  1  6  0  0  0
 13 27  1  1  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 13  1  0  0  0  0
 28 32  2  0  0  0  0
 29 33  1  0  0  0  0
 20 34  2  0     0  0
  7 35  1  6     0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 36 38  2  0     0  0
 30 39  1  0     0  0
  8 40  1  1     0  0
  9 40  1  1     0  0
 23 41  1  1     0  0
 17 42  1  1     0  0
 18 42  1  1     0  0
M  END
> <LM_ID>
LMST01160050

> <COMMON_NAME>
Physagulin F

> <SYSTEMATIC_NAME>
15alpha-acetoxy-5beta,6beta:16beta,17beta-diepoxy-4beta14beta,dihydroxy-1-oxo-witha2,24-dien-26,22-olide

> <FORMULA>
C30H38O9

> <MASS>
542.25

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Withanolides and derivatives [ST0116]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101599036

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01160050

$$$$