| Entry |
|
|---|
| Name |
Vinorelbine (INN);
Navelbine (TN) |
|---|
| Formula |
C45H54N4O8
|
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| Exact mass |
778.3942
|
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| Mol weight |
778.93
|
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| Structure |
|
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| Simcomp |
|
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| Class |
Antineoplastic
DG01965 Vinca alkaloid antineoplastic
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
|---|
| Remark |
| Product (DG00692): | D01935<JP/US> |
|
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| Efficacy |
Antineoplastic, Tubulin polymerization inhibitor |
|---|
| Comment |
Semisynthetic vinblastine derivative
|
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| Target |
|
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| Pathway |
|
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| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]
|
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| Interaction |
|
|---|
| Structure map |
| map07042 | Antineoplastics - agents from natural products |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L01 ANTINEOPLASTIC AGENTS
L01C PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
L01CA Vinca alkaloids and analogues
L01CA04 Vinorelbine
D08680 Vinorelbine (INN)
Drug groups [BR:br08330]
Antineoplastic
DG01965 Vinca alkaloid antineoplastic
DG00692 Vinorelbine
D08680 Vinorelbine
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00692 Vinorelbine
D08680 Vinorelbine
Target-based classification of drugs [BR:br08310]
Not elsewhere classified
Cellular process
Cytoskeleton
TUBB
D08680 Vinorelbine (INN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D08680
Drug groups [BR:br08330]
Antineoplastic
DG01965 Vinca alkaloid antineoplastic
DG00692 Vinorelbine
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00692 Vinorelbine
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 57
1 C1z C 27.0900 -27.5100
2 C8y C 25.9700 -26.7400
3 C1x C 28.3500 -26.7400
4 C7a C 26.7400 -28.7700
5 C8y C 25.9700 -25.3400
6 N4x N 24.8500 -27.3700
7 C1y C 28.3500 -25.4800
8 O7a O 25.2700 -29.2600
9 O6a O 27.5800 -29.8200
10 C8y C 23.6600 -25.3400
11 C8y C 23.6600 -26.7400
12 C1x C 27.2300 -24.8500
13 C1a C 24.4300 -30.6600
14 C8x C 22.4700 -24.7100
15 C8x C 22.4700 -27.3700
16 N1y N 27.2300 -23.5900
17 C8x C 21.4200 -25.3400
18 C8x C 21.4200 -26.7400
19 C1x C 28.3500 -22.8200
20 C2y C 29.4700 -23.4500
21 C2x C 29.4700 -24.6400
22 C1b C 30.7300 -22.7500
23 C1a C 31.9200 -23.4500
24 C1x C 25.9700 -23.9400
25 C1z C 34.6500 -29.6800
26 C1y C 35.7700 -28.9800
27 C1y C 34.6500 -30.9400
28 C1x C 33.8100 -28.5600
29 C1z C 36.8900 -29.6800
30 N1y N 35.7700 -27.6500
31 C1z C 35.7700 -31.6400
32 N1y N 33.5300 -31.6400
33 C8y C 32.4100 -30.9400
34 C1x C 34.4400 -27.6500
35 C1y C 36.8900 -30.9400
36 C2x C 38.0800 -28.9800
37 C1b C 38.0100 -30.3100
38 C1x C 36.8900 -27.0200
39 C7a C 36.6800 -32.7600
40 O1a O 35.2800 -33.5300
41 C1a C 33.5300 -32.9700
42 O7a O 40.2500 -32.2700
43 C2x C 38.0800 -27.6500
44 C1a C 39.1300 -29.6800
45 O7a O 36.6800 -34.0900
46 O6a O 38.0100 -32.2700
47 C1a C 37.8700 -34.7900
48 C1a C 42.7000 -32.2700
49 C7a C 41.4400 -31.5700
50 O6a O 41.4400 -30.1700
51 C8y C 32.4100 -29.6800
52 C8x C 31.2900 -29.0500
53 C8x C 31.2900 -31.6400
54 C8y C 30.1700 -29.6800
55 C8y C 30.1700 -31.0100
56 O2a O 29.0500 -31.6400
57 C1a C 27.9300 -31.0100
BOND 65
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 2
5 2 6 1
6 3 7 1
7 4 8 1
8 4 9 2
9 5 10 1
10 6 11 1
11 7 12 1
12 7 21 1
13 8 13 1
14 10 14 1
15 11 15 1
16 16 12 1
17 14 17 2
18 15 18 2
19 16 19 1
20 10 11 2
21 20 19 1
22 17 18 1
23 20 21 2
24 20 22 1
25 22 23 1
26 5 24 1
27 16 24 1 #Up
28 25 26 1
29 25 27 1
30 25 28 1 #Up
31 26 29 1
32 26 30 1
33 27 31 1
34 27 32 1
35 28 34 1
36 29 35 1
37 29 36 1
38 29 37 1 #Down
39 30 38 1
40 31 39 1 #Down
41 31 40 1 #Up
42 32 41 1
43 35 42 1 #Up
44 36 43 2
45 37 44 1
46 39 45 1
47 30 34 1
48 31 35 1
49 32 33 1
50 38 43 1
51 39 46 2
52 45 47 1
53 48 49 1
54 42 49 1
55 49 50 2
56 51 52 1
57 33 53 1
58 52 54 2
59 53 55 2
60 55 56 1
61 56 57 1
62 54 55 1
63 51 25 1
64 51 33 2
65 1 54 1 #Down
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