LMST03020532
  LIPID_MAPS_STRUCTURE_DATABASE

 39 41  0     0  0            999 V2000
    9.3653    6.5734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4773    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5894    6.5734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5894    7.5986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4773    8.1112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4773    9.1808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3341    9.6756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3341   10.6649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4773   11.1597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3653    7.5986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4773   12.1490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3341   12.6437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1908   12.1490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1908   11.1597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9046   11.1597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9046   12.1490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0478   12.6437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1908   12.9158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1908   10.4083    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7991   13.0776    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0478   13.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9046   14.1277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7613   13.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6180   14.1277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4747   13.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3316   14.1277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4747   12.6437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0478   14.6224    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0922   13.8892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2220    8.0933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.0787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2219    6.0787    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3316   13.1384    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3316   15.1169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1882   13.6332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1882   14.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6181   12.1492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3315   12.1492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4747   11.6545    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
 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
 10 30  2  0  0  0  0
  3 31  1  6  0  0  0
  1 32  1  1  0  0  0
 25 33  1  0  0  0  0
 26 34  1  0  0  0  0
 26 35  1  0  0  0  0
 26 36  1  0  0  0  0
 27 37  1  0  0  0  0
 27 38  1  0  0  0  0
 27 39  1  0  0  0  0
M  END
> <LM_ID>
LMST03020532

> <COMMON_NAME>
1alpha,25-dihydroxy-26,26, 26,27,27,27-hexamethylvitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R)-26,26, 26,27,27,27-hexamethyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol

> <FORMULA>
C33H56O3

> <MASS>
500.42

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1alpha,25-dihydroxy-26,26,26,27,27,27-hexamethylcholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547636

> <LIPIDBANK_ID>
VVD0623

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020532

$$$$