LMFA01030577
  LIPID_MAPS_STRUCTURE_DATABASE

 10  9  0  0  0  0  0  0  0  0999 V2000
   10.1303    6.2598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8575    5.8398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1303    6.9323    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3976    5.8398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6647    5.4199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9318    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1988    5.4199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4659    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7329    5.4199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  3  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
M  END
> <LM_ID>
LMFA01030577

> <COMMON_NAME>
2-octynoic acid

> <SYSTEMATIC_NAME>
2-octynoic acid

> <FORMULA>
C8H12O2

> <MASS>
140.08

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
2-Octynoic acid; 2-Octyn-1-oic acid; Pentylpropiolic acid

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
60295

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21872

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
5918

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA01030577

$$$$