LMFA01080019
  LIPID_MAPS_STRUCTURE_DATABASE

 15 14  0     0  0            999 V2000
   -0.4311   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4311   -0.7467    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4311    0.7467    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2998   -0.7467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1688   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0378   -0.7467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9068   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7758   -0.7467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6448   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5139   -0.7467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3829   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2519   -0.7467    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3829    0.7467    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1179   -0.2467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5168    1.2467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 11 13  1  0     0  0
 12 14  1  0     0  0
 13 15  1  0     0  0
M  END
> <LM_ID>
LMFA01080019

> <COMMON_NAME>
9,9-dimethoxy-nonanoic acid

> <SYSTEMATIC_NAME>
9,9-dimethoxy-nonanoic acid

> <FORMULA>
C11H22O4

> <MASS>
218.15

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Methoxy fatty acids [FA0108]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Nonanoic acid, 9,9-dimethoxy-

> <INCHI_KEY>
XDIISQHQFQMEIB-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C11H22O4/c1-14-11(15-2)9-7-5-3-4-6-8-10(12)13/h11H,3-9H2,1-2H3,(H,12,13)

> <SMILES>
C(CCCCCCCC(OC)OC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187033

> <ABBREVIATION>
FA 11:0;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11020360

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$