KEGG   COMPOUND: C16318Help
Entry
C16318                      Compound                               

Name
(+)-7-Isomethyljasmonate
Formula
C13H20O3
Exact mass
224.1412
Mol weight
224.2961
Structure
Mol fileKCF fileDB search
Pathway
map00592  alpha-Linolenic acid metabolism
map01110  Biosynthesis of secondary metabolites
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA02 Octadecanoids
   FA0202 jasmonic acids
    C16318  (+)-7-Isomethyljasmonate
BRITE hierarchy
Other DBs
PubChem: 47205626
ChEBI: 25242
ChEMBL: CHEMBL2272534
NIKKAJI: J415.509B
KCF data Show

ATOM        16
            1   C1y C    31.9400  -24.0736
            2   C1y C    31.9340  -25.4621
            3   C5x C    30.6215  -23.6535
            4   C1b C    33.3459  -22.8309
            5   C1x C    30.6389  -25.8880
            6   C1b C    33.1300  -26.1446
            7   C1x C    29.8163  -24.7794
            8   O5x O    30.1723  -22.3059
            9   C2b C    34.5361  -23.5310
            10  C7a C    34.3202  -25.4621
            11  C2b C    35.9013  -23.5310
            12  O7a O    35.5103  -26.1446
            13  C1b C    37.0856  -22.8309
            14  C1a C    38.2640  -23.5136
            15  O6a O    34.3135  -24.2595
            16  C1a C    36.7171  -25.4433
BOND        16
            1     1   3 1
            2     1   4 1 #Up
            3     2   5 1
            4     2   6 1 #Up
            5     3   7 1
            6     3   8 2
            7     4   9 1
            8     6  10 1
            9     9  11 2
            10   10  12 1
            11   11  13 1
            12   13  14 1
            13    5   7 1
            14   10  15 2
            15    1   2 1
            16   12  16 1

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