LMFA02020205
  LIPID_MAPS_STRUCTURE_DATABASE

 15 15  0  0  0  0  0  0  0  0999 V2000
    5.4927    6.9894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.3112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4926    5.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2898    5.8920    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.2898    6.7304    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.2337    7.7867    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9681    7.2231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7340    6.8821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4121    7.3748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1779    7.0339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8561    7.5266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9681    5.3993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7340    5.7402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4121    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7167    6.3791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  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
  5  7  1  1  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  4 12  1  6  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
M  END
> <LM_ID>
LMFA02020205

> <COMMON_NAME>
(+)-9,10-dihydrojasmonic acid

> <SYSTEMATIC_NAME>
[(1S,2S)-3-oxo-2-pentylcyclopentyl]acetic acid

> <FORMULA>
C12H20O3

> <MASS>
212.14

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Octadecanoids [FA02]

> <SUB_CLASS>
Jasmonic acids [FA0202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PQEYTAGBXNEUQL-UWVGGRQHSA-N

> <INCHI>
InChI=1S/C12H20O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h9-10H,2-8H2,1H3,(H,14,15)/t9-,10-/m0/s1

> <SMILES>
C1(=O)[C@@H](CCCCC)[C@H](CC(=O)O)CC1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
18436

> <ABBREVIATION>
FA 12:2;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
40469793

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Oxo fatty acids [FA0106]; Carbocyclic fatty acids [FA0114]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$