LMST01130028
  LIPID_MAPS_STRUCTURE_DATABASE

 33 38  0     0  0            999 V2000
    8.2100    8.6489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2907    8.1181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2907    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2100    6.5257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1292    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0486    6.5257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9680    7.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9680    8.1181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0486    8.6489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1292    8.1181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0486    9.7104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9680   10.2413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8873    9.7104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8873    8.6489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7261    8.6489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7261    9.7104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8068   10.2413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8873   10.5333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1292    8.8615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8068   11.0906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4021   10.5851    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6331    6.6769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9680    9.0205    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0285    7.7560    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1292    6.2666    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5992   11.5481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5992   12.4628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8068   12.9204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0145   12.4628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0145   11.5481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8068   13.6192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8956    7.9030    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9681   11.2265    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
 12 33  1  1     0  0
M  END
> <LM_ID>
LMST01130028

> <COMMON_NAME>
12beta-hydroxyresibufogenin

> <SYSTEMATIC_NAME>
3beta,12beta-dihydroxy-14beta,15beta-epoxy-5beta-bufa-20,22-dienolide

> <FORMULA>
C24H32O5

> <MASS>
400.22

> <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>
15513541

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMST01130028

$$$$