LMST03020189
  LIPID_MAPS_STRUCTURE_DATABASE

 34 36  0     0  0            999 V2000
    9.4543    6.9128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4980    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5419    6.9128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5419    8.0169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4980    8.5690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4980    9.7209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4209   10.2537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4209   11.3191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4980   11.8519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4543    8.0169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4980   12.9174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4209   13.4502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3434   12.9174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3434   11.8519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1890   11.8519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1890   12.9174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2662   13.4502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3434   13.7431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2634    8.4842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2662   14.3026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3986   14.5350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0044   14.7287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7426   14.3026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4808   14.7287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2188   14.3026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9572   14.7287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2188   13.5830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2634    6.4455    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.4455    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4808   15.5379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0281   13.8353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3434   11.0428    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0754   13.9173    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2662   15.1117    0.0000 H   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
 17 20  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  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
 20 21  1  6  0  0  0
  1 28  1  1  0  0  0
  3 29  1  6  0  0  0
 24 30  1  1  0  0  0
 25 31  1  0  0  0  0
 14 32  1  6  0  0  0
 17 33  1  6  0  0  0
 20 34  1  1  0  0  0
M  END
> <LM_ID>
LMST03020189

> <COMMON_NAME>
(22E)-(24R)-1alpha,24,25-trihydroxy-22,23-didehydrovitamin D3

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

> <FORMULA>
C27H42O4

> <MASS>
430.31

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(22E)-(24R)-1alpha,24,25-trihydroxy-22,23-didehydrocholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
178603

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283705

> <LIPIDBANK_ID>
VVD0207

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020189

$$$$