LMST03020614
  LIPID_MAPS_STRUCTURE_DATABASE

 38 41  0     0  0            999 V2000
    8.4623   12.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4623   11.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3290   10.5596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1956   11.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1956   12.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3290   12.5611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1473   10.7508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7355   11.5604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1473   12.3699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3290    9.5630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1473   13.3707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0139   13.8709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2842   13.8690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1956   13.0614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4623    9.0627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4623    8.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5958    7.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5958    6.5610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4623    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3290    6.5610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3290    7.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.0627    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1956   10.0593    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1921    6.0627    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8806   13.3707    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.7471   13.8709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6138   13.3707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4804   13.8709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4804   14.8716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6138   15.3720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7471   14.8716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3435   13.3726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2102   13.8730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3435   12.3760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2102   12.8722    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1921    8.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1473   14.3713    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0139   12.8703    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  1  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  3 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  1  0  0  0
  5 14  1  1  0  0  0
 10 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 16  1  0  0  0  0
 18 22  1  6  0  0  0
  4 23  1  6  0  0  0
 20 24  1  1  0  0  0
 12 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 26  1  0  0  0  0
 28 32  1  0  0  0  0
 32 33  1  0  0  0  0
 32 34  1  0  0  0  0
 32 35  1  0  0  0  0
 21 36  2  0  0  0  0
 11 37  1  6  0  0  0
  9 38  1  6  0  0  0
M  END
> <LM_ID>
LMST03020614

> <COMMON_NAME>
GS 1500

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R)-23-aza-23-[3-(1-hydroxy-1-methylethyl)-phenyl]-24,25,26,27-tetranor-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol

> <FORMULA>
C31H44O3S

> <MASS>
496.30

> <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>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
24779624

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020614

$$$$