LMST03020016
  LIPID_MAPS_STRUCTURE_DATABASE

 28 30  0     0  0            999 V2000
    9.2705    6.5754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3788    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4872    6.5754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4872    7.6050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3788    8.1198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3788    9.1938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2392    9.6907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2392   10.6842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3788   11.1810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2705    7.6050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3788   12.1745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2392   12.6713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0994   12.1745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0994   11.1810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8204   11.1810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8204   12.1745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9600   12.6713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0994   12.9445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0250    8.0406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.1398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0994   10.4265    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7146   13.1070    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9600   13.6648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8204   14.1615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9600   14.6582    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0004   13.9219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6806   13.6648    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8204   15.1548    0.0000 C   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  1  0  0  0  0
  5  6  2  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
 10 19  2  0  0  0  0
  3 20  1  6  0  0  0
 14 21  1  6  0  0  0
 17 22  1  6  0  0  0
 17 23  1  0  0  0  0
 24 23  1  0  0  0  0
 23 25  1  1  0  0  0
 23 26  1  6  0  0  0
 27 24  1  0  0  0  0
 24 28  1  6  0  0  0
M  END
> <LM_ID>
LMST03020016

> <COMMON_NAME>
(22S)-22-hydroxy-24,25,26,27-tetranorvitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(3S,22S)- 24-nor-9,10-seco-5,7,10(19)-cholatriene-3,22-diol

> <FORMULA>
C23H36O2

> <MASS>
344.27

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(22S)-22-hydroxy-23,24,25,26,27-pentanorcholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
173058

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547276

> <LIPIDBANK_ID>
VVD0017

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020016

$$$$