LMST01160085
  LIPID_MAPS_STRUCTURE_DATABASE

 39 45  0     0  0            999 V2000
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   -4.5003   -2.7319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7173   -1.7003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6081   -1.1863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8249   -3.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9345   -2.7319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9345   -1.7003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0455   -1.1863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0455   -0.1599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9345    0.3524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8249   -0.1599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9292   -1.5025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5294   -0.6722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0351    1.7022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8232    1.7022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8232    2.7337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7158    1.1863    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6064    1.7022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6064    2.7337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5003    1.1863    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5003    3.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7158    4.2794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9945    1.0327    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8249   -2.0100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8921   -1.0148    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9292    0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5916   -3.7889    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9454    0.2610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.9292    2.1863    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 18  1  1  0  0  0
  4  5  1  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  5 19  1  1  0  0  0
  6 17  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 14  1  0  0  0  0
 11 12  1  0  0  0  0
 11 15  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 15 16  1  0  0  0  0
 20 21  1  6  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 27  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 28  2  0  0  0  0
 26 27  2  0  0  0  0
 26 29  1  0  0  0  0
 27 30  1  0  0  0  0
 22 31  1  6     0  0
 10 32  1  6     0  0
  9 33  1  1     0  0
 12 34  1  0  0  0  0
 16 34  1  0  0  0  0
 34 20  1  0  0  0  0
  4 35  1  1     0  0
  7 35  1  1     0  0
 16 36  1  6     0  0
 34 36  1  6     0  0
 11 37  1  6     0  0
 12 38  1  1     0  0
 20 39  1  0     0  0
M  END
> <LM_ID>
LMST01160085

> <COMMON_NAME>
20-Hydroxytubocapsanolide A

> <SYSTEMATIC_NAME>
5beta,6beta:16alpha,17alpha-diepoxy-4beta,20-dihydroxy-1-oxo-witha-2,24-dienolide

> <FORMULA>
C28H36O7

> <MASS>
484.25

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Withanolides and derivatives [ST0116]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
66326

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
16680370

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST01160085

$$$$