LMFA07040189
  LIPID_MAPS_STRUCTURE_DATABASE

  9  9  0     0  0            999 V2000
   12.2095    3.6663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6162    2.7527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8731    2.0836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0071    2.5836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2150    3.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5944    2.5449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1410    3.0835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3000    1.8765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1410    4.0835    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  1  1  0     0  0
  2  6  2  0     0  0
  4  7  1  0     0  0
  4  8  1  1     0  0
  7  9  2  0     0  0
M  END
> <LM_ID>
LMFA07040189

> <COMMON_NAME>
S-Lavender lactone

> <SYSTEMATIC_NAME>
(5S)-5beta-Vinyl-5-methyltetrahydrofuran-2-one

> <FORMULA>
C7H10O2

> <MASS>
126.07

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QESPSAHXYXIGBG-SSDOTTSWSA-N

> <INCHI>
InChI=1S/C7H10O2/c1-3-7(2)5-4-6(8)9-7/h3H,1,4-5H2,2H3/t7-/m1/s1

> <SMILES>
C1C[C@@](C)(C=C)OC1=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 7:2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11344024

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
559136

> <CITATION>
23509009

$$$$