LMST03010041
  LIPID_MAPS_STRUCTURE_DATABASE

 34 36  0  0  0  0  0  0  0  0999 V2000
    7.6504    5.4252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9139    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1776    5.4252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1776    6.2755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9139    6.7006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9139    7.5877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6246    7.9981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6246    8.8186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9139    9.2289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6504    6.2755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9139   10.0494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6246   10.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3351   10.0494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3351    9.2289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7564    9.2289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7564   10.0494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0458   10.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3351   10.6854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2735    6.6353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.0653    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3351    8.6057    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6689   10.8196    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0458   11.2802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7563   11.6904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4669   11.2802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1775   11.6904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8880   11.2802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5986   11.6904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8880   10.4597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0458   12.1007    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2533   11.4926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1775   12.5109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3609    5.0149    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5986   10.8700    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
 10 19  2  0  0  0  0
  3 20  1  6  0  0  0
 14 21  1  6  0  0  0
 17 22  1  6  0  0  0
 17 23  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  2  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 27 29  1  0  0  0  0
 23 30  1  1  0  0  0
 23 31  1  6  0  0  0
 26 32  1  1  0  0  0
  1 33  1  1  0  0  0
 27 34  1  0  0  0  0
M  END
> <LM_ID>
LMST03010041

> <COMMON_NAME>
1alpha,25-dihydroxy-24-epivitamin D2 / 1alpha,25-dihydroxy-24-epiergocalciferol

> <SYSTEMATIC_NAME>
(5Z,7E,22E)-(1S,3R,24R)-9,10-seco-5,7,10(19),22-ergostatetraene-1,3,25-triol

> <FORMULA>
C28H44O3

> <MASS>
428.33

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D2 and derivatives [ST0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547244

> <LIPIDBANK_ID>
VVD0383

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03010041

$$$$