LMST03020154
  LIPID_MAPS_STRUCTURE_DATABASE

 32 34  0     0  0            999 V2000
    7.9587    6.9086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0096    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.9086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.0045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0096    8.5524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0096    9.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9255   10.2246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9255   11.2821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0096   11.8109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9587    8.0045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0096   12.8684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9255   13.3972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8411   12.8684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8411   11.8109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6728   11.8109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6728   12.8684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7571   13.3972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8411   13.6880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7618    8.4682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7571   14.2431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8959   14.4738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4897   14.6661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2223   14.2431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9550   14.6661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6875   14.2431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4204   14.6661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6875   13.5290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7618    6.4448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4907   13.7794    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8411   11.0078    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5602   13.8610    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7571   15.0463    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  2  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  1  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
 25 29  1  0  0  0  0
 14 30  1  6  0  0  0
 17 31  1  6  0  0  0
 20 32  1  1  0  0  0
M  END
> <LM_ID>
LMST03020154

> <COMMON_NAME>
1alpha,25-dihydroxy-9,11-didehydro-3-deoxyvitamin D3 /

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S)-9,10-seco-5,7,10(19),9(11)-cholestatetraene-1,25-diol

> <FORMULA>
C27H42O2

> <MASS>
398.32

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1alpha,25-dihydroxy-9,11-didehydro-3-deoxycholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283682

> <LIPIDBANK_ID>
VVD0172

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020154

$$$$