LMST01160012
  LIPID_MAPS_STRUCTURE_DATABASE

 40 44  0     0  0            999 V2000
   -0.5761   -0.7842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9019   -2.2827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9019   -1.2836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0360   -0.7842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0360    0.2148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3060    0.2148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4401    0.7142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5761    0.2148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1702   -0.2847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1702   -1.2836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3060   -0.7842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4401   -1.2836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4401   -2.2827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3060   -2.7821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3060   -3.7812    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1702   -3.2817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1702   -2.2827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0360   -2.7821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0360   -3.7812    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2891    0.7144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1544    0.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1544   -0.7842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2891    1.7187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1588    2.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5806    2.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1589    3.2251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0286    3.7273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8983    3.2251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8983    2.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0286    1.7187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0286    4.7315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7680    3.7273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7680    1.7187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5759    1.2191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1148    2.7077    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2781    0.8888    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3527   -0.4840    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3060   -1.5374    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2328    1.5582    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3159   -1.7543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 18  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  6  7  1  0  0  0  0
  6 11  1  0  0  0  0
  7  8  1  0  0  0  0
 10 11  1  0  0  0  0
 10 17  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  6  0  0  0
 14 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  1  0  0  0
 17 16  1  1  0  0  0
 10  9  1  1  0  0  0
  8 20  1  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
  1 22  1  0     0  0
 20 23  1  0     0  0
 23 24  1  0     0  0
 23 25  1  0     0  0
 24 26  1  0     0  0
 26 27  1  0     0  0
 27 28  2  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 24  1  0     0  0
 27 31  1  0     0  0
 28 32  1  0     0  0
 29 33  2  0     0  0
  8 34  1  1     0  0
 23 35  1  1     0  0
 20 36  1  1     0  0
 12 37  1  1     0  0
 11 38  1  6     0  0
 24 39  1  6     0  0
  1 40  1  6     0  0
M  END
> <LM_ID>
LMST01160012

> <COMMON_NAME>
Physalolactone

> <SYSTEMATIC_NAME>
17S,20S,22R-6alpha-chloro-4beta,5beta,17beta,14alpha,20alpha-pentahydroxy-1-oxo-ergosta-2,24-dienolide

> <FORMULA>
C28H39O8Cl

> <MASS>
538.23

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Withanolides and derivatives [ST0116]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
HMDB0034333

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5458763

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01160012

$$$$