LMST03020416
  LIPID_MAPS_STRUCTURE_DATABASE

 34 36  0     0  0            999 V2000
    9.3612    6.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4745    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5880    6.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5880    7.8962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4745    8.4081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4745    9.4761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3301    9.9701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3301   10.9580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4745   11.4521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3612    7.8962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4745   12.4398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3301   12.9339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1855   12.4398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1855   11.4521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8967   11.4521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8967   12.4398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0411   12.9339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1855   13.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1855   10.7016    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7914   13.3671    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0411   13.9216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8967   14.4156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7522   13.9216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6076   14.4156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4631   13.9216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3186   14.4156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4631   12.9339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0411   14.9095    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0870   14.1774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.3785    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2165    8.3900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1740   13.9217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3185   12.4399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3185   13.4278    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
 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
  3 30  1  6  0  0  0
 10 31  2  0  0  0  0
 26 32  1  0  0  0  0
 27 33  1  0  0  0  0
 25 34  1  0  0  0  0
M  END
> <LM_ID>
LMST03020416

> <COMMON_NAME>
25-hydroxy-26,27-dimethylvitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(3S)-26,27-dimethyl-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol

> <FORMULA>
C29H48O2

> <MASS>
428.37

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
25-hydroxy-26,27-dimethylcholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
166751

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547523

> <LIPIDBANK_ID>
VVD0506

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020416

$$$$