| Entry |
|
|---|
| Name |
Sinapoyl aldehyde;
Sinapaldehyde
|
|---|
| Formula |
C11H12O4
|
|---|
| Exact mass |
208.0736
|
|---|
| Mol weight |
208.21
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01061 | Biosynthesis of phenylpropanoids |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00039 | Monolignol biosynthesis, phenylalanine/tyrosine => monolignol |
|
|---|
| Enzyme |
|
|---|
| Brite |
Phytochemical compounds [BR:br08003]
Phenylpropanoids
Monolignols
Sinapate derivatives
C05610 Sinapoyl aldehyde
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 15
1 C8y C 23.1700 -20.0200
2 C8x C 23.1700 -21.4200
3 C8y C 24.3824 -22.1200
4 C8y C 25.5949 -21.4200
5 C8y C 25.5949 -20.0200
6 C8x C 24.3824 -19.3200
7 O2a O 26.8260 -19.3090
8 C1a C 26.8260 -17.9090
9 O2a O 24.3824 -23.5198
10 C1a C 23.1532 -24.2297
11 O1a O 26.8260 -22.1310
12 C2b C 21.9576 -19.3200
13 C2b C 20.7621 -20.0104
14 C4a C 19.5747 -19.3249
15 O4a O 19.5747 -17.9249
BOND 15
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 5 7 1
8 7 8 1
9 3 9 1
10 9 10 1
11 4 11 1
12 1 12 1
13 12 13 2
14 13 14 1
15 14 15 2
|
|---|
