LMST03020166
  LIPID_MAPS_STRUCTURE_DATABASE

 33 35  0     0  0            999 V2000
    9.0014    6.9097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0504    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0994    6.9097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0994    8.0078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0504    8.5569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0504    9.7026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9682   10.2326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9682   11.2921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0504   11.8220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0014    8.0078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0504   12.8816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9682   13.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8858   12.8816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8858   11.8220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7213   11.8220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7213   12.8816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8036   13.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8858   13.7031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8063    8.4725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8036   14.2593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9406   14.4905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5378   14.6832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2718   14.2593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0060   14.6832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7401   14.2593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4744   14.6832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7401   13.5437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1634   10.8275    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5449   13.7946    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945    6.4449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8858   11.0173    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6083   13.8763    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8036   15.0642    0.0000 H   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  2  0  0  0  0
  7  8  1  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
 17 20  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  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
 20 21  1  6  0  0  0
  8 28  1  6  0  0  0
 25 29  1  0  0  0  0
  3 30  2  0  0  0  0
 14 31  1  6  0  0  0
 17 32  1  6  0  0  0
 20 33  1  1  0  0  0
M  END
> <LM_ID>
LMST03020166

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
(6E)-(8S)-8,25-dihydroxy-9,10-seco-4,6,10(19)-cholestatrien-3-one

> <FORMULA>
C27H42O3

> <MASS>
414.31

> <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>
169000

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283691

> <LIPIDBANK_ID>
VVD0184

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://www.lipidmaps.org/databases/lmsd/LMST03020166

$$$$