| Entry |
|
|---|
| Name |
Pirarubicin (JP18/INN);
Therarubicin (TN) |
|---|
| Formula |
C32H37NO12
|
|---|
| Exact mass |
627.2316
|
|---|
| Mol weight |
627.63
|
|---|
| Structure |
|
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| Simcomp |
|
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| Source |
Streptomyces peucetius [TAX: 1950]
|
|---|
| Class |
Antineoplastic
DG01682 Anthracycline antineoplastic
DG01529 Topoisomerase inhibitor
DG01527 Topoisomerase II inhibitor
|
|---|
| Remark |
| Product (DG00702): | D08386<JP> |
|
|---|
| Efficacy |
Antineoplastic, Topoisomerase II inhibitor |
|---|
| Comment |
Anthracyclines (semisynthetic)
|
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| Target |
|
|---|
| 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
L01D CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
L01DB Anthracyclines and related substances
L01DB08 Pirarubicin
D01885 Pirarubicin (JP18/INN)
Drug groups [BR:br08330]
Antineoplastic
DG01682 Anthracycline antineoplastic
DG00702 Pirarubicin
D01885 Pirarubicin
DG01529 Topoisomerase inhibitor
DG01527 Topoisomerase II inhibitor
DG00702 Pirarubicin
D01885 Pirarubicin
Target-based classification of drugs [BR:br08310]
Enzymes
Isomerases (EC5)
DNA topoisomerase
TOP2
D01885 Pirarubicin (JP18/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D01885 Pirarubicin
Drug groups [BR:br08330]
Antineoplastic
DG01682 Anthracycline antineoplastic
DG00702 Pirarubicin
DG01529 Topoisomerase inhibitor
DG01527 Topoisomerase II inhibitor
DG00702 Pirarubicin
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 45
1 C1y C 45.7100 -16.0300
2 O2x O 46.9281 -16.7201
3 C1x C 48.1348 -16.0103
4 C1x C 48.1934 -14.6103
5 C1x C 46.9053 -13.9202
6 C1x C 45.6986 -14.6300
7 C8x C 31.2200 -10.4300
8 C8x C 31.2200 -11.8300
9 C8y C 32.4100 -12.5300
10 C8y C 33.6700 -11.8300
11 C8y C 33.6700 -10.4300
12 C8x C 32.4100 -9.7300
13 C5x C 34.8600 -12.5300
14 C8y C 36.0500 -11.8300
15 C8y C 36.0500 -10.4300
16 C5x C 34.8600 -9.7300
17 C8y C 37.3100 -12.5300
18 C8y C 38.5000 -11.8300
19 C8y C 38.5000 -10.4300
20 C8y C 37.3100 -9.7300
21 C1y C 39.6900 -12.5300
22 C1x C 40.9500 -11.8300
23 C1z C 40.9500 -10.4300
24 C1x C 39.6900 -9.7300
25 O2a O 32.4100 -13.9300
26 C1a C 31.2200 -14.6300
27 O5x O 34.8600 -13.9300
28 O5x O 34.8600 -8.3300
29 O1a O 37.3100 -8.3300
30 O1a O 37.3100 -13.9300
31 O2a O 39.6900 -13.9300
32 C1y C 40.8800 -14.6300
33 C5a C 42.1400 -9.7300
34 C1b C 43.3300 -10.4300
35 O1a O 44.5200 -9.7300
36 O5a O 42.1400 -8.3300
37 O1a O 42.1400 -11.1300
38 C1x C 40.8800 -16.0300
39 C1y C 42.1400 -16.7300
40 C1y C 43.3300 -16.0300
41 C1y C 43.3300 -14.6300
42 O2x O 42.1400 -13.9300
43 N1a N 42.1400 -18.1300
44 C1a C 44.5200 -13.9300
45 O2a O 44.5200 -16.7300
BOND 50
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 7 8 2
8 8 9 1
9 9 10 2
10 10 11 1
11 11 12 2
12 7 12 1
13 10 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 11 16 1
18 14 17 2
19 17 18 1
20 18 19 2
21 19 20 1
22 15 20 2
23 18 21 1
24 21 22 1
25 22 23 1
26 23 24 1
27 19 24 1
28 9 25 1
29 25 26 1
30 13 27 2
31 16 28 2
32 20 29 1
33 17 30 1
34 32 31 1 #Down
35 21 31 1 #Down
36 23 33 1 #Up
37 33 34 1
38 34 35 1
39 33 36 2
40 23 37 1 #Down
41 32 38 1
42 38 39 1
43 39 40 1
44 40 41 1
45 41 42 1
46 32 42 1
47 39 43 1 #Up
48 41 44 1 #Up
49 40 45 1 #Up
50 1 45 1 #Up
|
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