Entry |
|
Name |
Metadoxine; Metadoxil (TN) |
Formula |
C8H11NO3. C5H7NO3
|
Exact mass |
298.1165
|
Mol weight |
298.2918
|
Structure |
|
Component |
|
Remark |
|
Efficacy |
Hepatoprotectant |
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A05 BILE AND LIVER THERAPY
A05B LIVER THERAPY, LIPOTROPICS
A05BA Liver therapy
A05BA09 Metadoxine
D08186 Metadoxine
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 21
1 C8y C 22.4700 -19.1100
2 C8y C 23.7300 -18.4100
3 C8y C 21.2800 -18.4100
4 C1b C 22.4700 -20.5100
5 C8x C 23.7300 -16.9400
6 C1b C 24.9200 -19.1100
7 C8y C 21.2800 -16.9400
8 O1a O 20.0900 -19.1100
9 O1a O 23.6600 -21.2100
10 N5x N 22.4700 -16.2400
11 O1a O 26.1100 -18.4100
12 C1a C 20.0900 -16.2400
13 C5x C 12.1100 -18.1300
14 C1x C 12.5300 -19.4600
15 C1x C 13.9300 -19.4600
16 C1y C 14.3500 -18.1300
17 N1x N 13.2300 -17.3600
18 O5x O 10.7800 -17.7100
19 C6a C 15.5400 -17.4300
20 O6a O 16.8000 -18.1300
21 O6a O 15.5400 -16.0300
BOND 21
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 2
10 6 11 1
11 7 12 1
12 7 10 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 13 17 1
18 13 18 2
19 16 19 1 #Down
20 19 20 1
21 19 21 2
|