LMFA05000612
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0            999 V2000
   -1.8033   -1.4429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4451   -1.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4451   -0.2403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7229    0.1606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0818   -0.1599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3604    0.2403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3611   -0.2403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0825    0.1606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0825    1.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7236    1.4429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4451    1.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3611   -1.0420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0825   -1.4429    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  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  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
 12 13  1  0  0  0  0
M  END
> <LM_ID>
LMFA05000612

> <COMMON_NAME>
2-Butyl-1-octanol

> <SYSTEMATIC_NAME>
2-butyloctan-1-ol

> <FORMULA>
C12H26O

> <MASS>
186.20

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty alcohols [FA05]

> <SUB_CLASS>
-

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XMVBHZBLHNOQON-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C12H26O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h12-13H,3-11H2,1-2H3

> <SMILES>
CCCCCCC(CO)CCCC

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0041288

> <CHEBI_ID>
84235

> <ABBREVIATION>
FOH 12:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
19800

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$