LMFA01170150
  LIPID_MAPS_STRUCTURE_DATABASE

 34 33  0     0  0            999 V2000
    8.5980   -3.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5980   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7320   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8659   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9999   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1339   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2679   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4019   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5358   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6698   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8038   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0622   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9282   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7943   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6603   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5264   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5264   -3.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3924   -4.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4640   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4640   -5.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3301   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1961   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0621   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9281   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7941   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6602   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5262   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3922   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2582   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1242   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9903   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8563   -4.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8563   -5.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.7224   -4.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  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
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  2  0     0  0
 16 18  1  0     0  0
  2 19  1  0     0  0
 19 20  1  0     0  0
 19 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  0     0  0
 32 33  2  0     0  0
 32 34  1  0     0  0
M  END
> <LM_ID>
LMFA01170150

> <COMMON_NAME>
13,14-dimethyloctacosanedioic acid

> <SYSTEMATIC_NAME>
13,14-dimethyloctacosanedioic acid

> <FORMULA>
C30H58O4

> <MASS>
482.43

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Dicarboxylic acids [FA0117]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BWSMSGXFEDFDNR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C30H58O4/c1-27(23-19-15-11-7-4-3-5-9-13-17-21-25-29(31)32)28(2)24-20-16-12-8-6-10-14-18-22-26-30(33)34/h27-28H,3-26H2,1-2H3,(H,31,32)(H,33,34)

> <SMILES>
CC(C(CCCCCCCCCCCC(O)=O)C)CCCCCCCCCCCCCC(O)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 30:1;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
57495473

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
2336

> <CITATION>
9098079

$$$$