LMFA07010712
  LIPID_MAPS_STRUCTURE_DATABASE

 11 10  0  0  0  0            999 V2000
   -2.5011    0.2069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5011   -0.6181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7861    0.6195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0712    0.2069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0712   -0.6181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3562    0.6195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3575    0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0725    0.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3561   -0.6195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861    0.2029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5011    0.6139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010712

> <COMMON_NAME>
1-Methylbutyl butanoate

> <SYSTEMATIC_NAME>
pentan-2-yl butanoate

> <FORMULA>
C9H18O2

> <MASS>
158.13

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Wax monoesters [FA0701]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
HMDB0039219

> <YMDB_ID>
-

> <CHEBI_ID>
179875

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
43263

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA07010712

$$$$