| Entry |
|
|---|
| Name |
Phloretate;
Phloretic acid;
3-(4-Hydroxyphenyl)propanoate;
3-(4-Hydroxyphenyl)propionic acid
|
|---|
| Formula |
C9H10O3
|
|---|
| Exact mass |
166.063
|
|---|
| Mol weight |
166.1739
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
|
|---|
| Module |
| M00967 | Flavone degradation, luteolin/apigenin => DHCA/phloretate |
|
|---|
| Enzyme |
|
|---|
| Brite |
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 12
1 C8y C 12.9500 -21.7000
2 C8x C 12.9500 -23.1000
3 C8x C 14.1624 -23.8000
4 C8y C 15.3749 -23.1000
5 C8x C 15.3749 -21.7000
6 C8x C 14.1624 -21.0000
7 O1a O 11.7376 -21.0000
8 C1b C 16.6124 -23.8000
9 C1b C 17.8249 -23.1000
10 C6a C 19.0373 -23.8000
11 O6a O 20.2497 -23.1000
12 O6a O 19.0373 -25.2000
BOND 12
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 4 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 10 12 2
|
|---|
