LMFA01020155
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0  0  0  0  0999 V2000
    5.7145    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1435    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5725    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2869    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0014    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7159    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4304    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7159    6.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994    6.1269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8745    6.1269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
  9 11  2  0  0  0  0
  7 12  1  0  0  0  0
  7 13  1  0  0  0  0
M  END
> <LM_ID>
LMFA01020155

> <COMMON_NAME>
3,3-dimethyl-nonanoic acid

> <SYSTEMATIC_NAME>
3,3-dimethyl-nonanoic acid

> <FORMULA>
C11H22O2

> <MASS>
186.16

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YTISNWDNLZEHQA-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C11H22O2/c1-4-5-6-7-8-11(2,3)9-10(12)13/h4-9H2,1-3H3,(H,12,13)

> <SMILES>
C(CCCCC(C)(C)CC(=O)O)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179394

> <ABBREVIATION>
FA 11:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5282685

> <LIPIDBANK_ID>
DFA7123

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$