LMFA01020347
  LIPID_MAPS_STRUCTURE_DATABASE

 15 14  0  0  0  0  0  0  0  0999 V2000
   12.0786    6.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7811    5.8110    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0786    7.0277    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3711    5.8110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6632    6.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9553    5.8110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2474    6.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5394    5.8110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8315    6.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1237    5.8110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4158    6.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7079    5.8110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3539    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0618    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  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
  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
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
M  END
> <LM_ID>
LMFA01020347

> <COMMON_NAME>
11:0(10Me,10Me)

> <SYSTEMATIC_NAME>
10,10-dimethyl-undecanoic acid

> <FORMULA>
C13H26O2

> <MASS>
214.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
VYDBDDDTZMNNMM-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C13H26O2/c1-13(2,3)11-9-7-5-4-6-8-10-12(14)15/h4-11H2,1-3H3,(H,14,15)

> <SMILES>
C(CCCCCCCCC(C)(C)C)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
180119

> <ABBREVIATION>
FA 13:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14371787

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1191330

> <CITATION>
12691847

$$$$