KEGG   COMPOUND: C22438
Entry
C22438                      Compound                               
Name
3,5-Dehydroshikimate
Formula
C7H6O5
Exact mass
170.0215
Mol weight
170.12
Structure
Reaction
Pathway
map00999  Biosynthesis of various plant secondary metabolites
Enzyme
Other DBs
PubChem: 497619797
LinkDB
KCF data

ATOM        12
            1   C2y C    18.6572  -15.1502
            2   C1x C    19.8496  -15.8516
            3   C2x C    17.4649  -15.8516
            4   C6a C    18.6572  -13.7474
            5   C5x C    19.8496  -17.2544
            6   C5x C    17.4649  -17.2544
            7   O6a O    19.8496  -13.0460
            8   O6a O    17.4649  -13.0460
            9   C1y C    18.6572  -17.9558
            10  O5x O    21.1121  -17.9558
            11  O5x O    16.2023  -17.9558
            12  O1a O    18.6572  -19.3586
BOND        12
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     5  10 2
            10    6  11 2
            11    9  12 1 #Down
            12    6   9 1

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