Entry |
|
Name |
Shikimate;
Shikimic acid;
3,4,5-Trihydroxy-1-cyclohexenecarboxylic acid
|
Formula |
C7H10O5
|
Exact mass |
174.0528
|
Mol weight |
174.15
|
Structure |

|
Reaction |
|
Pathway |
map00400 | Phenylalanine, tyrosine and tryptophan biosynthesis |
map00996 | Biosynthesis of various alkaloids |
map00999 | Biosynthesis of various plant secondary metabolites |
map01060 | Biosynthesis of plant secondary metabolites |
map01061 | Biosynthesis of phenylpropanoids |
map01063 | Biosynthesis of alkaloids derived from shikimate pathway |
map01110 | Biosynthesis of secondary metabolites |
|
Module |
M00022 | Shikimate pathway, phosphoenolpyruvate + erythrose-4P => chorismate |
|
Enzyme |
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 12
1 C2y C 22.1200 -15.1127
2 C1x C 23.3375 -15.8112
3 C2x C 20.9090 -15.8112
4 C6a C 22.1137 -13.7223
5 C1y C 23.3375 -17.2208
6 C1y C 20.9090 -17.2208
7 O6a O 23.3182 -13.0238
8 O6a O 20.9025 -13.0301
9 C1y C 22.1200 -17.9322
10 O1a O 24.5485 -17.9128
11 O1a O 19.6978 -17.9128
12 O1a O 22.1137 -19.3290
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 1 #Up
10 6 11 1 #Down
11 9 12 1 #Down
12 6 9 1
|