| Entry |
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|---|
| Name |
Phloroglucinol;
1,3,5-Benzenetriol;
1,3,5-Trihydroxybenzene;
Benzene-1,3,5-triol
|
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| Formula |
C6H6O3
|
|---|
| Exact mass |
126.0317
|
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| Mol weight |
126.11
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| Structure |
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| Remark |
|
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| Reaction |
|
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| Pathway |
| map01120 | Microbial metabolism in diverse environments |
|
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| Module |
| M00967 | Flavone degradation, luteolin/apigenin => DHCA/phloretate |
|
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| Enzyme |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03A DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03AX Other drugs for functional gastrointestinal disorders
A03AX12 Phloroglucinol
D00152 Phloroglucinol (JAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01497 Catechol O-methyltransferase inhibitor
DG00050 Phloroglucinol
D00152 Phloroglucinol
Target-based classification of drugs [BR:br08310]
Enzymes
Transferases (EC2)
Methyltransferases
COMT
D00152 Phloroglucinol (JAN)
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| Other DBs |
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| KCF data |
ATOM 9
1 C8y C 17.2005 -16.1739
2 C8x C 17.2005 -14.7661
3 C8x C 18.4037 -16.8844
4 O1a O 15.9908 -16.8651
5 C8y C 18.4037 -14.0684
6 C8y C 19.6260 -16.1739
7 C8x C 19.6260 -14.7661
8 O1a O 18.4037 -12.6796
9 O1a O 20.8355 -16.8651
BOND 9
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 5 7 1
7 5 8 1
8 6 9 1
9 6 7 2
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