LMST03020380
  LIPID_MAPS_STRUCTURE_DATABASE

 34 36  0     0  0            999 V2000
    9.3612    6.5725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4746    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5880    6.5725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5880    7.5963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4746    8.1081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4746    9.1762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3302    9.6702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3302   10.6580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4746   11.1520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3612    7.5963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4746   12.1399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3302   12.6339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1856   12.1399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1856   11.1520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8968   11.1520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8968   12.1399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0413   12.6339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1856   12.9055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1856   10.4017    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7914   13.0671    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0413   13.6217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8966   14.1156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7522   13.6217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6077   14.1156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4631   13.6217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3186   14.1156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4631   12.6339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0413   14.6095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0871   13.8774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.0786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2166    8.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2166    6.0786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3186   13.1278    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5931   14.7329    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  6  0  0  0
 21 29  1  1  0  0  0
  3 30  1  6  0  0  0
 10 31  2  0  0  0  0
  1 32  1  1  0  0  0
 25 33  1  0  0  0  0
 29 34  1  0  0  0  0
M  END
> <LM_ID>
LMST03020380

> <COMMON_NAME>
(20S)-1alpha,25-dihydroxy-20-methoxyvitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R,20S)-20-methoxy-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol

> <FORMULA>
C28H46O4

> <MASS>
446.34

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(20S)-1alpha,25-dihydroxy-20-methoxycholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
178541

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547492

> <LIPIDBANK_ID>
VVD0464

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://www.lipidmaps.org/databases/lmsd/LMST03020380

$$$$