LMFA05000130
  LIPID_MAPS_STRUCTURE_DATABASE

  9  8  0  0  0  0  0  0  0  0999 V2000
   13.0004    6.0607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1388    6.5583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2708    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4025    6.5582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5341    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6657    6.5582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7975    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9291    6.5582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.0607    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
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
M  END
> <LM_ID>
LMFA05000130

> <COMMON_NAME>
n-octanol

> <SYSTEMATIC_NAME>
Octan-1-ol

> <FORMULA>
C8H18O

> <MASS>
130.14

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty alcohols [FA05]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>
1-octanol

> <INCHI_KEY>
KBPLFHHGFOOTCA-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3

> <SMILES>
OCCCCCCCC

> <KEGG_ID>
C00756

> <HMDB_ID>
HMDB0001183

> <CHEBI_ID>
16188

> <ABBREVIATION>
FOH 8:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
957

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
303

> <CITATION>
37050113

$$$$