LMFA07040008
  LIPID_MAPS_STRUCTURE_DATABASE

  7  7  0     0  0            999 V2000
    7.1025    8.4293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9227    7.8575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6323    6.9005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6325    6.8809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0828    9.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3050    7.8258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  1  6  2  0  0  0  0
  1  7  1  0  0  0  0
  4  7  1  0  0  0  0
M  END
> <LM_ID>
LMFA07040008

> <COMMON_NAME>
gamma-valerolactone

> <SYSTEMATIC_NAME>
Dihydro-5-methylfuran-2(3H)-one

> <FORMULA>
C5H8O2

> <MASS>
100.05

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GAEKPEKOJKCEMS-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C5H8O2/c1-4-2-3-5(6)7-4/h4H,2-3H2,1H3

> <SMILES>
C1(OC(C)CC1)=O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0033840

> <CHEBI_ID>
48569

> <ABBREVIATION>
FA 5:1

> <CAYMAN_ID>
28240

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
7921

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
23486087

$$$$