LMST03020220
  LIPID_MAPS_STRUCTURE_DATABASE

 31 33  0     0  0            999 V2000
    8.6718    6.9101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7200    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7681    6.9101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7681    8.0093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7200    8.5589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7200    9.7055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6386   10.2359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6386   11.2965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7200   11.8268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6718    8.0093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7200   12.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6386   13.4179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5569   12.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5569   11.8268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3941   11.8268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3941   12.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4756   13.4179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5569   13.7096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4756   14.2663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6118   14.4977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2104   14.6906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9453   14.2663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6800   14.6906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4147   14.2663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1496   14.6906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4147   13.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5569   11.0214    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2811   13.8830    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4756   15.0718    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.4178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4275    6.4739    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
 17 19  1  0  0  0  0
 19 21  1  0  0  0  0
 21 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
 24 26  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
 19 20  1  6  0  0  0
 14 27  1  6  0  0  0
 17 28  1  6  0  0  0
 19 29  1  1  0  0  0
  4 30  2  0  0  0  0
  1 31  1  1  0  0  0
M  END
> <LM_ID>
LMST03020220

> <COMMON_NAME>
(5E)-vitamin D3

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

> <FORMULA>
C27H44O

> <MASS>
384.34

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(5E)-cholecalciferol; (5E)-calciol

> <KEGG_ID>
-

> <HMDB_ID>
HMDB06719

> <YMDB_ID>
-

> <CHEBI_ID>
145213

> <CAYMAN_ID>
31225

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283711

> <LIPIDBANK_ID>
VVD0239

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020220

$$$$