| Entry |
|
|---|
| Name |
DIBOA-glucoside;
2,4-Dihydroxy-1,4-benzoxazin-3-one glucoside;
(2R)-4-Hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside
|
|---|
| Formula |
C14H17NO9
|
|---|
| Exact mass |
343.0903
|
|---|
| Mol weight |
343.2861
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00999 | Biosynthesis of various plant secondary metabolites |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00952 | Benzoxazinoid biosynthesis, indoleglycerol phosphate => DIMBOA-glucoside |
|
|---|
| Enzyme |
|
|---|
| Brite |
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C15772
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 24
1 C8y C 14.9246 -18.2990
2 C8y C 14.9305 -16.9056
3 N1y N 16.1257 -18.9986
4 C8x C 13.7238 -18.9927
5 O2x O 16.1373 -16.2061
6 C8x C 13.7238 -16.2003
7 C5x C 17.3324 -18.3107
8 O1b O 16.1081 -20.3860
9 C8x C 12.5111 -18.2990
10 C1y C 17.3381 -16.9115
11 C8x C 12.5111 -16.9056
12 O5x O 18.5275 -18.9986
13 O2a O 18.5509 -16.2120
14 C1y C 19.7518 -15.5123
15 O2x O 20.9468 -16.2003
16 C1y C 19.7518 -14.1249
17 C1y C 22.1536 -15.5123
18 C1y C 20.9525 -13.4310
19 O1a O 18.5509 -13.4252
20 C1y C 22.1536 -14.1306
21 C1b C 23.3544 -16.2061
22 O1a O 20.9525 -12.0437
23 O1a O 23.3544 -13.4310
24 O1a O 24.7478 -15.3433
BOND 26
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 2
12 7 10 1
13 9 11 1
14 14 13 1 #Up
15 14 15 1
16 14 16 1
17 15 17 1
18 16 18 1
19 16 19 1 #Down
20 17 20 1
21 17 21 1 #Up
22 18 22 1 #Up
23 20 23 1 #Down
24 21 24 1
25 18 20 1
26 10 13 1 #Down
|
|---|
