| Entry |
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|---|
| Name |
Shikimate;
Shikimic acid;
3,4,5-Trihydroxy-1-cyclohexenecarboxylic acid
|
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| Formula |
C7H10O5
|
|---|
| Exact mass |
174.0528
|
|---|
| Mol weight |
174.15
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| Structure |
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| Reaction |
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| 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 |
|
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| Module |
| M00022 | Shikimate pathway, phosphoenolpyruvate + erythrose-4P => chorismate |
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| Enzyme |
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| Other DBs |
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| LinkDB |
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| 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
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