LMST03020674
  LIPID_MAPS_STRUCTURE_DATABASE

 35 37  0  0  0  0  0  0  0  0999 V2000
    7.6966    8.1372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6966    8.9595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4116    9.3723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4116   10.1980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6966   10.6108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9816   10.1980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9816    9.3723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1968    9.1172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6821    9.7851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1968   10.4531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4116   11.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1968   11.2787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9089   11.6899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9943   10.6668    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4116    8.5467    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6240   11.2770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3390   11.6899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0540   11.2770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4818   11.6915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7690   11.6899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0540   10.4548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7690   10.8642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4840   11.2770    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6240   10.4548    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1968   12.1043    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815    7.7244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815    6.8988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2665    6.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2665    5.6603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6966    5.6603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6966    6.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4087    6.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.2492    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4087    5.2492    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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  1  0  0  0  0
  6  7  1  0  0  0  0
  7  2  1  0  0  0  0
  3  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  4  1  0  0  0  0
  4 11  1  1  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 10 14  1  6  0  0  0
  3 15  1  6  0  0  0
 13 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 12 19  1  6  0  0  0
 18 20  1  0  0  0  0
 18 21  1  0  0  0  0
 18 22  1  1  0  0  0
 20 23  1  0  0  0  0
 16 24  1  6  0  0  0
 12 25  1  1  0  0  0
  1 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 27  1  0  0  0  0
 32 33  2  0  0  0  0
 29 34  1  6  0  0  0
 31 35  1  1  0  0  0
M  END
> <LM_ID>
LMST03020674

> <COMMON_NAME>
1alpha,23R,25S,26-Tetrahydroxyvitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R,23R,25S)-9,10-seco-5,7,10(19)-cholestatriene-1,3,23,25,26-pentol

> <FORMULA>
C27H44O5

> <MASS>
448.32

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
190383

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
24779647

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020674

$$$$