LMST03020253
  LIPID_MAPS_STRUCTURE_DATABASE

 33 35  0     0  0            999 V2000
    9.4616    6.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5753    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6891    6.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6891    7.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5753    8.4074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5753    9.4751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4306    9.9689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4306   10.9564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5753   11.4504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4616    7.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5753   12.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4306   12.9316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2858   12.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2858   11.4504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9963   11.4504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9963   12.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1410   12.9316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2858   13.2032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2858   10.7003    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8910   13.3647    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1410   13.9191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9963   14.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8515   13.9191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7066   14.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5618   13.9191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4169   14.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5618   12.9316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1410   14.9066    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1872   14.1747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8340    6.3786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3168    8.3894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7202    9.9688    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.9688    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 11  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  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
  1 10  1  0  0  0  0
  5 10  1  0  0  0  0
  8 14  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18  1  1  0  0  0
 14 19  1  6  0  0  0
 17 20  1  6  0  0  0
 17 21  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 25 27  1  0  0  0  0
 21 28  1  1  0  0  0
 21 29  1  6  0  0  0
  3 30  1  6  0  0  0
 10 31  2  0  0  0  0
  6 32  1  1  0  0  0
 32 33  1  0  0  0  0
M  END
> <LM_ID>
LMST03020253

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
(7E)-(3S,6S)-6-hydroperoxy-9,10-seco-4,7,10(19)-cholestatrien-3-ol

> <FORMULA>
C27H44O3

> <MASS>
416.33

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
173067

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547435

> <LIPIDBANK_ID>
VVD0280

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020253

$$$$