LMFA01020156
  LIPID_MAPS_STRUCTURE_DATABASE

 14 13  0  0  0  0  0  0  0  0999 V2000
    5.7144    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8578    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5724    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2868    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0014    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7158    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4303    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1448    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8593    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1448    6.4850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7158    6.4849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  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
 11 10  1  0  0  0  0
 10 12  2  0  0  0  0
  8 13  1  1  0  0  0
  1 14  1  0  0  0  0
M  END
> <LM_ID>
LMFA01020156

> <COMMON_NAME>
3R-methyl-undecanoic acid

> <SYSTEMATIC_NAME>
3R-methyl-undecanoic acid

> <FORMULA>
C12H24O2

> <MASS>
200.18

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SHTJBHFHMAKAPT-LLVKDONJSA-N

> <INCHI>
InChI=1S/C12H24O2/c1-3-4-5-6-7-8-9-11(2)10-12(13)14/h11H,3-10H2,1-2H3,(H,13,14)/t11-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
179760

> <ABBREVIATION>
FA 12:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5282686

> <LIPIDBANK_ID>
DFA7124

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$