| Entry |
|
|---|
| Name |
Vinblastine (INN);
Vinblastina (TN) |
|---|
| Formula |
C46H58N4O9
|
|---|
| Exact mass |
810.4204
|
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| Mol weight |
810.9741
|
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| Structure |
|
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| Simcomp |
|
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| Source |
Catharanthus roseus [TAX: 4058]
|
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| Class |
Antineoplastic
DG01965 Vinca alkaloid antineoplastic
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
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| Remark |
| Product (DG00689): | D01068<JP/US> |
|
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| Efficacy |
Antineoplastic, Tubulin polymerization inhibitor |
|---|
| Comment |
Vinca alkaloid
|
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| Target |
|
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| Pathway |
|
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| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]
|
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| Interaction |
|
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| Structure map |
| map07042 | Antineoplastics - agents from natural products |
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| Other map |
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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
L01CA01 Vinblastine
D08675 Vinblastine (INN)
Drug groups [BR:br08330]
Antineoplastic
DG01965 Vinca alkaloid antineoplastic
DG00689 Vinblastine
D08675 Vinblastine
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00689 Vinblastine
D08675 Vinblastine
Target-based classification of drugs [BR:br08310]
Not elsewhere classified
Cellular process
Cytoskeleton
TUBB
D08675 Vinblastine (INN)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D08675
Drug groups [BR:br08330]
Antineoplastic
DG01965 Vinca alkaloid antineoplastic
DG00689 Vinblastine
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00689 Vinblastine
|
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| Other DBs |
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| KCF data |
ATOM 59
1 C1z C 19.1800 -16.6600
2 C8y C 18.0600 -15.8900
3 C1x C 20.4400 -15.8900
4 C7a C 18.8300 -17.9200
5 C8y C 18.0600 -14.4900
6 N4x N 16.9400 -16.5200
7 C1y C 20.4400 -14.6300
8 O7a O 17.3600 -18.4100
9 O6a O 19.6700 -18.9700
10 C8y C 15.7500 -14.4900
11 C1x C 17.2900 -13.3700
12 C8y C 15.7500 -15.8900
13 C1x C 19.3200 -14.0000
14 C1a C 16.5200 -19.8100
15 C8x C 14.5600 -13.8600
16 C1x C 18.0600 -12.3900
17 C8x C 14.5600 -16.5200
18 N1y N 19.3200 -12.7400
19 C8x C 13.5100 -14.4900
20 C8x C 13.5100 -15.8900
21 C1x C 20.4400 -11.9700
22 C1z C 21.5600 -12.6000
23 C1x C 21.5600 -13.7900
24 O1a O 22.8200 -11.9000
25 C1b C 22.7500 -13.3000
26 C1a C 22.7500 -14.7000
27 C1z C 26.7400 -18.8300
28 C1y C 27.8600 -18.1300
29 C1y C 26.7400 -20.0900
30 C1x C 25.9000 -17.7100
31 C1z C 28.9800 -18.8300
32 N1y N 27.8600 -16.8000
33 C1z C 27.8600 -20.7900
34 N1y N 25.6200 -20.7900
35 C8y C 24.5000 -20.0900
36 C1x C 26.5300 -16.8000
37 C1y C 28.9800 -20.0900
38 C2x C 30.1700 -18.1300
39 C1b C 30.1000 -19.4600
40 C1x C 28.9800 -16.1700
41 C7a C 28.7700 -21.9100
42 O1a O 27.3700 -22.6800
43 C1a C 25.6200 -22.1200
44 O7a O 32.3400 -21.4200
45 C2x C 30.1700 -16.8000
46 C1a C 31.2200 -18.8300
47 O7a O 28.7700 -23.2400
48 O6a O 30.1000 -21.4200
49 C1a C 29.9600 -23.9400
50 C1a C 34.7900 -21.4200
51 C7a C 33.5300 -20.7200
52 O6a O 33.5300 -19.3200
53 C8y C 24.5000 -18.8300
54 C8x C 23.3800 -18.2000
55 C8x C 23.3800 -20.7900
56 C8y C 22.2600 -18.8300
57 C8y C 22.2600 -20.1600
58 O2a O 21.1400 -20.7900
59 C1a C 20.0200 -20.1600
BOND 67
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 5 11 1
11 6 12 1
12 7 13 1 #Down
13 7 23 1
14 8 14 1
15 10 15 1
16 11 16 1
17 12 17 1
18 18 13 1 #Down
19 15 19 2
20 17 20 2
21 18 21 1
22 10 12 2
23 16 18 1
24 22 21 1
25 19 20 1
26 22 23 1
27 22 24 1 #Up
28 22 25 1 #Down
29 25 26 1
30 27 28 1
31 27 29 1
32 27 30 1 #Up
33 28 31 1
34 28 32 1
35 29 33 1
36 29 34 1
37 30 36 1
38 31 37 1
39 31 38 1
40 31 39 1 #Down
41 32 40 1
42 33 41 1 #Down
43 33 42 1 #Up
44 34 43 1
45 37 44 1 #Up
46 38 45 2
47 39 46 1
48 41 47 1
49 32 36 1
50 33 37 1
51 34 35 1
52 40 45 1
53 41 48 2
54 47 49 1
55 50 51 1
56 44 51 1
57 51 52 2
58 53 54 1
59 35 55 1
60 54 56 2
61 55 57 2
62 57 58 1
63 58 59 1
64 56 57 1
65 53 27 1
66 53 35 2
67 1 56 1 #Down
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