LMST03020134
  LIPID_MAPS_STRUCTURE_DATABASE

 33 35  0     0  0            999 V2000
    9.2728    6.8758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3802    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4878    6.8758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4878    7.9064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3802    8.4216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3802    9.4967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2415    9.9940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2415   10.9884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3802   11.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2728    7.9064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3802   12.4802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2415   12.9774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1025   12.4802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1025   11.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8250   11.4858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8250   12.4802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9639   12.9774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1025   13.2508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0279    8.3424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.4397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1025   10.7305    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7191   13.4135    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9639   13.9717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8250   14.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6862   13.9717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5473   14.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4084   13.9717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2696   14.4689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4084   12.9774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9639   14.9661    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0033   14.2291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6266    8.4036    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.6266    7.4092    0.0000 F   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  1  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
  4 32  1  0  0  0  0
  4 33  1  0  0  0  0
M  END
> <LM_ID>
LMST03020134

> <COMMON_NAME>
4,4-difluorovitamin D3

> <SYSTEMATIC_NAME>
(5E,7E)-(3S)-4,4-difluoro-9,10-seco-5,7,10(19)-cholestatrien-3-ol

> <FORMULA>
C27H42OF2

> <MASS>
420.32

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
4,4-difluorocholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547379

> <LIPIDBANK_ID>
VVD0152

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020134

$$$$