LMGL01020028
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0  0  0  0  0999 V2000
   12.1599    5.7131    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4471    6.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7339    5.7131    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.0210    6.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3080    5.7131    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1461    5.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3218    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5900    6.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8720    5.7131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1540    6.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4360    5.7131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7180    6.1235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.7131    0.0000 C   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
  3  7  1  6  0  0  0
  3  6  1  1  0  0  0
  4  5  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
M  END
> <LM_ID>
LMGL01020028

> <COMMON_NAME>
1-Hexylglycerol

> <SYSTEMATIC_NAME>
1-O-hexyl-sn-glycerol

> <FORMULA>
C9H20O3

> <MASS>
176.14

> <CATEGORY>
Glycerolipids [GL]

> <MAIN_CLASS>
Monoradylglycerols [GL01]

> <SUB_CLASS>
Monoalkylglycerols [GL0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
MG(O-6:0)

> <INCHI_KEY>
MQVMITUCTLYRNV-VIFPVBQESA-N

> <INCHI>
InChI=1S/C9H20O3/c1-2-3-4-5-6-12-8-9(11)7-10/h9-11H,2-8H2,1H3/t9-/m0/s1

> <SMILES>
OC[C@]([H])(O)COCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
168806

> <ABBREVIATION>
MG O-6:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10313344

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
9593157

$$$$