| Entry |
|
|---|
| Name |
Melinamide (JAN);
Artes (TN) |
|---|
| Formula |
C26H41NO
|
|---|
| Exact mass |
383.3188
|
|---|
| Mol weight |
383.6098
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Efficacy |
Antihyperlipidemic, Cholesterol acyltransferase (ACAT) inhibitor |
|---|
| Comment |
Unsaturated fatty acid
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Enzymes
Transferases (EC2)
Acyltransferases
SOAT
D01202 Melinamide (JAN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 28
1 C8y C 21.1651 -17.1899
2 C8x C 21.1651 -18.5929
3 C8x C 19.9471 -19.2944
4 C8x C 18.7362 -18.5929
5 C8x C 18.7362 -17.1899
6 C8x C 19.9471 -16.4884
7 C1c C 22.3768 -16.4884
8 N1b N 23.5885 -17.1827
9 C5a C 24.8002 -16.4812
10 C1b C 26.0119 -17.1758
11 C1b C 27.2236 -16.4742
12 C1b C 28.4353 -17.1686
13 C2b C 29.6471 -16.4671
14 C1a C 22.3737 -15.0853
15 O5a O 24.7971 -15.0782
16 C2b C 31.0471 -16.4671
17 C1b C 32.2924 -17.1500
18 C2b C 33.5049 -16.4500
19 C2b C 34.9049 -16.4500
20 C1b C 36.1424 -17.1500
21 C1b C 37.3549 -16.4500
22 C1a C 39.1273 -17.1500
23 C1b C 26.0119 -17.1758
24 C1b C 27.2236 -16.4742
25 C1b C 26.0119 -17.1758
26 C1b C 27.2236 -16.4742
27 C1b C 36.1424 -17.1500
28 C1b C 37.3549 -16.4500
BOND 28
1 1 7 1
2 1 2 2
3 7 8 1
4 2 3 1
5 8 9 1
6 3 4 2
7 4 5 1
8 7 14 1
9 9 15 2
10 5 6 2
11 6 1 1
12 12 13 1
13 13 16 2
14 16 17 1
15 17 18 1
16 18 19 2
17 9 10 1
18 10 11 1
19 11 23 1
20 23 24 1
21 24 25 1
22 25 26 1
23 26 12 1
24 19 20 1
25 20 21 1
26 21 27 1
27 27 28 1
28 28 22 1
BRACKET 1 25.9000 -18.1300 25.9000 -16.1700
1 27.3000 -16.1700 27.3000 -18.1300
1 3
ORIGINAL 1 10 11
REPEAT 1 23 24 25 26
2 35.9800 -17.9900 35.9800 -16.1700
2 37.4500 -16.1700 37.4500 -17.9900
2 2
ORIGINAL 2 20 21
REPEAT 2 27 28
|
|---|
