LMFA02020016
  LIPID_MAPS_STRUCTURE_DATABASE

 16 16  0  0  0  0  0  0  0  0999 V2000
    6.2525    6.4689    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.2490    5.6500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4749    6.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0817    7.2018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4851    5.3989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9543    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2100    7.5115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7836    6.7890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6563    5.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5887    6.7890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3582    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2873    7.2018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9823    6.7992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6523    6.3593    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0604    5.6556    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
  1  4  1  1  0  0  0
  2  5  1  0  0  0  0
  2  6  1  1  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  6 10  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
  5  7  1  0  0  0  0
 10 15  2  0  0  0  0
 12 16  1  0  0  0  0
M  END
> <LM_ID>
LMFA02020016

> <COMMON_NAME>
methyl (+)-7-isojasmonate

> <SYSTEMATIC_NAME>
methyl {(1R,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate

> <FORMULA>
C13H20O3

> <MASS>
224.14

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Jasmonic acids [FA0202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(+)-7-isojasmonic acid methyl ester;(1R,2S)-Methyl jasmonate;(3R,7S)-Methyl jasmonate; methyl 7-epi-jasmonate

> <KEGG_ID>
C16318

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
25242

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6427970

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://www.lipidmaps.org/databases/lmsd/LMFA02020016

$$$$