LMST03020588
  LIPID_MAPS_STRUCTURE_DATABASE

 35 37  0     0  0            999 V2000
   11.8674    6.5696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9858    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1043    6.5696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1043    7.5877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9858    8.0965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9858    9.1586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8366    9.6498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8366   10.6321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9858   11.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8674    7.5877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9858   12.1056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8366   12.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6872   12.1056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6872   11.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3886   11.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3886   12.1056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5380   12.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6872   10.3772    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2840   13.0277    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5380   13.5791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3886   14.0702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7181    8.0787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2536    6.0786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7180    6.0786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6872   13.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6874   14.0702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8366   13.5789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9860   13.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1352   13.5789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2846   13.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4340   13.5789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5833   13.0878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327   13.5789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5833   12.1056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   12.5966    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  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
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 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
 14 18  1  6  0  0  0
 17 19  1  6  0  0  0
 17 20  1  0  0  0  0
 21 20  1  0  0  0  0
 10 22  2  0  0  0  0
  3 23  1  6  0  0  0
  1 24  1  1  0  0  0
 13 25  1  1  0  0  0
 20 26  1  0  0  0  0
 27 25  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 32 33  1  0  0  0  0
 32 34  1  0  0  0  0
 32 35  1  0  0  0  0
M  END
> <LM_ID>
LMST03020588

> <COMMON_NAME>
1alpha-hydroxy-18-(5-hydroxy-5-methylhexyloxy)-23,24,25,26,27-pentanorvitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R)-18-(5-hydroxy-5-methylhexyloxy)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol

> <FORMULA>
C29H48O4

> <MASS>
460.36

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1alpha-hydroxy-18-(5-hydroxy-5-methylhexyloxy)-23,24,25,26,27-pentanorcholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547683

> <LIPIDBANK_ID>
VVD0690

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020588

$$$$