LMST01130011
  LIPID_MAPS_STRUCTURE_DATABASE

 32 36  0     0  0            999 V2000
    8.2954    8.7389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3665    8.2025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3665    7.1299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2954    6.5936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2242    7.1299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1531    6.5936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0821    7.1299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0821    8.2025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1531    8.7389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2242    8.2025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1531    9.8114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0821   10.3478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0109    9.8114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0109    8.7389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8688    8.7389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8688    9.8114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9399   10.3478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0109   10.6428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2242    8.9536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9399   11.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5415   10.6952    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7021    6.7464    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0821    9.1143    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1328    7.8367    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2242    6.3318    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7406   11.6682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7406   12.5924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9399   13.0547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1395   12.5924    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1395   11.6682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9399   13.7608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3621    9.4513    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  2  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
 19 32  1  0     0  0
M  END
> <LM_ID>
LMST01130011

> <COMMON_NAME>
Bufohydrolide B

> <SYSTEMATIC_NAME>
3beta,19-dihydroxy-5beta-bufa-14,20,22-trienolide

> <FORMULA>
C24H32O4

> <MASS>
384.23

> <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>
171119422

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01130011

$$$$