LMST01130018
  LIPID_MAPS_STRUCTURE_DATABASE

 35 40  0     0  0            999 V2000
    8.2166    8.6559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2966    8.1246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2966    7.0622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2166    6.5309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1366    7.0622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0567    6.5309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9769    7.0622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9769    8.1246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0567    8.6559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1366    8.1246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0567    9.7182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9769   10.2495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8968    9.7182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8968    8.6559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7371    8.6559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7371    9.7182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8171   10.2495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8968   10.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1366    8.8686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8171   11.0995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4129   10.5936    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6384    6.6823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9769    9.0277    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0366    7.7623    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1366    6.2716    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.6101   11.5574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6101   12.4728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8171   12.9307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0242   12.4728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0242   11.5574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8171   13.6301    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8320    7.9094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7845    7.1754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9306    6.6824    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7846    8.1614    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  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 20  1  0     0  0
  1 10  1  0     0  0
  5 10  1  0     0  0
  9 10  1  0     0  0
  8 14  1  0     0  0
 13 17  1  0     0  0
 13 18  1  1     0  0
 10 19  1  1     0  0
 17 21  1  6     0  0
  3 22  1  1     0  0
  8 23  1  1     0  0
  9 24  1  6     0  0
  5 25  1  1     0  0
 20 26  1  0     0  0
 26 27  2  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 20  2  0     0  0
 28 31  2  0     0  0
 15 32  1  1     0  0
 14 32  1  1     0  0
 22 33  1  0     0  0
 33 34  1  0     0  0
 33 35  2  0     0  0
M  END
> <LM_ID>
LMST01130018

> <COMMON_NAME>
3beta-formyloxyresibufogenin

> <SYSTEMATIC_NAME>
3beta-formyl-14beta,15beta-epoxy-5beta-bufa-20,22-dienolide

> <FORMULA>
C25H32O5

> <MASS>
412.22

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Bufanolides and derivatives [ST0113]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10916635

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01130018

$$$$