LMFA12000120
  LIPID_MAPS_STRUCTURE_DATABASE

 10  9  0  0  0  0  0  0  0  0999 V2000
   10.3588    6.3107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5935    5.8720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8280    6.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0624    5.8720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2968    6.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5312    5.8720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7656    6.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5935    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8280    6.9350    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
  2  9  2  0  0  0  0
  3 10  1  1  0  0  0
M  END
> <LM_ID>
LMFA12000120

> <COMMON_NAME>
3R-Hydroxyoctan-2-one

> <SYSTEMATIC_NAME>
3R-Hydroxyoctan-2-one

> <FORMULA>
C8H16O2

> <MASS>
144.12

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QWEHQNZGVUHHME-MRVPVSSYSA-N

> <INCHI>
InChI=1S/C8H16O2/c1-3-4-5-6-8(10)7(2)9/h8,10H,3-6H2,1-2H3/t8-/m1/s1

> <SMILES>
CC(=O)[C@H](O)CCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179951

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10898831

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$