LMST01010514
  LIPID_MAPS_STRUCTURE_DATABASE

 42 45  0     0  0            999 V2000
   10.2484    9.2648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1052    8.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3872    8.7751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2569   10.2569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3830    9.7673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9622    9.2522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1052    7.7704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3830    7.7789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5261    9.2691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1221   10.7465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5667   10.6975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3941    9.8543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9749   10.2442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6759    9.2310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9537    8.2644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2399    7.2768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5261    7.2809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6651    8.7751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8402   10.7296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9706   11.2362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6886   10.2231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6651    7.7789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0196    6.4240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0157    6.4240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8360   11.7216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5497   10.7253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7997    7.2852    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6886   12.2156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9706   12.2156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8318   12.7177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5497   11.7259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6843   13.2116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4066   12.2240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2635   11.7343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0968    9.7757    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5049    8.2770    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.4025   11.1141    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1359   12.2432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2680   10.7244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1296   11.2343    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4029   13.2240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2671   13.7272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  1  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4 10  1  0  0  0  0
  4 11  2  0  0  0  0
  5 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  1  6  0  0  0
  7 16  1  0  0  0  0
  8 17  1  0  0  0  0
  9 18  1  0  0  0  0
 13 19  1  0  0  0  0
 13 20  1  1  0  0  0
 14 21  1  0  0  0  0
 17 22  1  0  0  0  0
 17 23  1  0  0  0  0
 17 24  1  0  0  0  0
 19 25  1  0  0  0  0
 21 26  1  6  0  0  0
 22 27  1  1  0  0  0
 25 28  1  0  0  0  0
 25 29  1  6  0  0  0
 25 30  1  1  0  0  0
 28 31  1  0  0  0  0
 28 32  2  0  0  0  0
 31 33  1  0  0  0  0
 33 34  1  0  0  0  0
  8 16  2  0  0  0  0
 10 13  1  0  0  0  0
 18 22  1  0  0  0  0
 19 21  1  0  0  0  0
  2 35  1  1  0  0  0
  3 36  1  6  0  0  0
 19 37  1  6  0  0  0
 34 38  1  0     0  0
 34 39  1  0     0  0
 34 40  1  0     0  0
 33 41  1  1     0  0
 41 42  1  0     0  0
M  END
> <LM_ID>
LMST01010514

> <COMMON_NAME>
Cucurbitacin C4

> <SYSTEMATIC_NAME>
24(R)-methoxy-3beta,16alpha,19,20beta,25-pentahydroxycucurbit-5-en-11,22-dione

> <FORMULA>
C31H50O8

> <MASS>
550.35

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Cholesterol and derivatives [ST0101]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171119975

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01010514

$$$$