LMFA01150023
  LIPID_MAPS_STRUCTURE_DATABASE

 17 17  0     0  0            999 V2000
   -2.6469   -0.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8505   -0.2202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0541   -0.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2577   -0.2202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5716   -0.7881    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3351   -0.2202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1315   -0.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9279   -0.2202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7243   -0.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5207   -0.2202    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0223    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0551    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5961    1.7618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5187    1.7618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5839   -0.1390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7243   -1.7618    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5207   -0.6800    0.0000 C   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
  4 11  2  0     0  0
  6 12  2  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 11 14  1  0     0  0
  1 15  1  0     0  0
  9 16  2  0     0  0
 15 17  1  0     0  0
M  END
> <LM_ID>
LMFA01150023

> <COMMON_NAME>
3-(3,4-dimethyl-5-pentylfuran-2-yl)-propanoic acid

> <SYSTEMATIC_NAME>
3-(5-pentyl-3,4-dimethylfuran-2-yl)-propanoic acid

> <FORMULA>
C14H22O3

> <MASS>
238.16

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Heterocyclic fatty acids [FA0115]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
3D5; 3,4-dimethyl-5-pentyl-2-furanpropanoic acid

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0112083

> <YMDB_ID>
-

> <CHEBI_ID>
168605

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
23425504

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA01150023

$$$$