LMST03020479
  LIPID_MAPS_STRUCTURE_DATABASE

 37 40  0     0  0            999 V2000
    9.3646    6.5732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4768    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5892    6.5732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5892    7.5982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4768    8.1106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4768    9.1800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3335    9.6747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3335   10.6638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4768   11.1584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3646    7.5982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4768   12.1474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3335   12.6420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1899   12.1474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1899   11.1584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9032   11.1584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9032   12.1474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0467   12.6420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1899   12.9140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1899   10.4072    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7978   13.0758    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0467   13.6311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9032   14.1255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7598   13.6311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0467   14.6201    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0913   13.8871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2211    8.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    6.0787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2210    6.0787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7598   12.6420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6163   12.1475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4728   12.6420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4728   13.6311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6163   14.1255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3293   14.1255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3293   15.1146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1858   13.6311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1858   14.6201    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
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  8  9  1  0  0  0  0
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  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
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 14 19  1  6  0  0  0
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 21 25  1  6  0  0  0
 10 26  2  0  0  0  0
  3 27  1  6  0  0  0
  1 28  1  1  0  0  0
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M  END
> <LM_ID>
LMST03020479

> <COMMON_NAME>
1alpha-hydroxy-22-[3-(1-hydroxy-1-methylethyl)phenyl]-23,24,25,26,27-pentanorvitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R)-22-[3-(1-hydroxy-1-methylethyl)phenyl]-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol

> <FORMULA>
C31H44O3

> <MASS>
464.33

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1alpha-hydroxy-22-[3-(1-hydroxy-1-methylethyl)phenyl]-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>
9547583

> <LIPIDBANK_ID>
VVD0569

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020479

$$$$