| Entry |
|
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| Name |
Phenoxymethylpenicillin calcium;
Calcipen (TN) |
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| Formula |
(C16H17N2O5S)2. 4H2O. Ca
|
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| Exact mass |
810.1765
|
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| Mol weight |
810.91
|
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| Structure |
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| Class |
Antibacterial
DG01710 beta-Lactam antibiotic
DG01713 Penicillin skeleton group
DG01480 Penicillin
DG01778 beta-Lactamase sensitive penicillin
|
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| Remark |
| Product (DG00535): | D00497<US> |
|
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| Efficacy |
Antibacterial, Cell wall biosynthesis inhibitor |
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| Target |
penicillin binding protein |
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| Pathway |
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| Interaction |
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| Structure map |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
J ANTIINFECTIVES FOR SYSTEMIC USE
J01 ANTIBACTERIALS FOR SYSTEMIC USE
J01C BETA-LACTAM ANTIBACTERIALS, PENICILLINS
J01CE Beta-lactamase sensitive penicillins
J01CE02 Phenoxymethylpenicillin
D08360 Phenoxymethylpenicillin calcium
Drug groups [BR:br08330]
Antibacterial
DG01710 beta-Lactam antibiotic
DG01713 Penicillin skeleton group
DG01480 Penicillin
DG00535 Phenoxymethylpenicillin
D08360 Phenoxymethylpenicillin calcium
DG01778 beta-Lactamase sensitive penicillin
DG00535 Phenoxymethylpenicillin
D08360 Phenoxymethylpenicillin calcium
Antimicrobials [BR:br08307]
Antibacterials
Cell wall biosynthesis inhibitor, beta-lactam
beta-Lactamase sensitive penicillin
D08360 Phenoxymethylpenicillin calcium
Drug groups [BR:br08330]
Antibacterial
DG01710 beta-Lactam antibiotic
DG01713 Penicillin skeleton group
DG01480 Penicillin
DG00535 Phenoxymethylpenicillin
DG01778 beta-Lactamase sensitive penicillin
DG00535 Phenoxymethylpenicillin
Antimicrobials abbreviations [BR:br08327]
Antibacterials
Cell wall biosynthesis inhibitor, beta-lactam
beta-Lactamase sensitive penicillin
DG00535 Phenoxymethylpenicillin
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 53
1 C1y C 20.4400 -17.2200
2 C5x C 20.4400 -18.6200
3 N1y N 21.8400 -18.6200
4 C1y C 21.8400 -17.2200
5 C1y C 23.1700 -19.0400
6 C1z C 24.0100 -17.9200
7 S2x S 23.1700 -16.8000
8 C1a C 24.9900 -18.9000
9 C1a C 24.9900 -16.9400
10 C6a C 23.6600 -20.3700
11 O6a O 25.0600 -20.3700 #-
12 O6a O 22.8200 -21.4900
13 N1b N 19.2500 -16.5200
14 C5a C 18.0600 -17.2200
15 O5x O 19.2500 -19.3200
16 O5a O 18.0600 -18.6200
17 C1b C 16.8700 -16.5200
18 O2a O 15.6800 -17.2200
19 C8y C 14.4200 -16.5200
20 C8x C 14.4200 -15.1200
21 C8x C 13.2300 -14.4200
22 C8x C 12.0400 -15.1200
23 C8x C 12.0400 -16.5200
24 C8x C 13.2300 -17.2200
25 Z Ca 29.4700 -18.9700 #2+
26 O0 O 32.2000 -16.0300
27 C1y C 20.4400 -17.2200
28 C5x C 20.4400 -18.6200
29 N1y N 21.8400 -18.6200
30 C1y C 21.8400 -17.2200
31 S2x S 23.1700 -16.8000
32 C1z C 24.0100 -17.9200
33 C1y C 23.1700 -19.0400
34 C6a C 23.6600 -20.3700
35 O6a O 25.0600 -20.3700 #-
36 O6a O 22.8200 -21.4900
37 C1a C 24.9900 -18.9000
38 C1a C 24.9900 -16.9400
39 O5x O 19.2500 -19.3200
40 N1b N 19.2500 -16.5200
41 C5a C 18.0600 -17.2200
42 O5a O 18.0600 -18.6200
43 C1b C 16.8700 -16.5200
44 O2a O 15.6800 -17.2200
45 C8y C 14.4200 -16.5200
46 C8x C 14.4200 -15.1200
47 C8x C 13.2300 -14.4200
48 C8x C 12.0400 -15.1200
49 C8x C 12.0400 -16.5200
50 C8x C 13.2300 -17.2200
51 O0 O 32.2000 -16.0300
52 O0 O 32.2000 -16.0300
53 O0 O 32.2000 -16.0300
BOND 52
1 1 2 1
2 2 3 1
3 3 4 1
4 1 4 1
5 3 5 1
6 5 6 1
7 6 7 1
8 4 7 1
9 6 8 1
10 6 9 1
11 5 10 1 #Down
12 10 11 1
13 10 12 2
14 1 13 1 #Up
15 13 14 1
16 2 15 2
17 14 16 2
18 14 17 1
19 17 18 1
20 18 19 1
21 19 20 2
22 20 21 1
23 21 22 2
24 22 23 1
25 23 24 2
26 19 24 1
27 27 28 1
28 28 29 1
29 29 30 1
30 27 30 1
31 29 33 1
32 33 32 1
33 32 31 1
34 30 31 1
35 32 37 1
36 32 38 1
37 33 34 1 #Down
38 34 35 1
39 34 36 2
40 27 40 1 #Up
41 40 41 1
42 28 39 2
43 41 42 2
44 41 43 1
45 43 44 1
46 44 45 1
47 45 46 2
48 46 47 1
49 47 48 2
50 48 49 1
51 49 50 2
52 45 50 1
BRACKET 1 11.5500 -22.1200 11.5500 -14.0000
1 26.9500 -14.0000 26.9500 -22.1200
1 2
ORIGINAL 1 1 2 3 4 7 6 5 10 11 12 8 9 13 16 14 15
1 17 18 19 20 21 22 23 24 25
REPEAT 1 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43
1 44 45 46 47 48 49 50 51 52
2 30.0300 -16.8000 30.0300 -15.1200
2 33.0400 -15.1200 33.0400 -16.8000
2 4
ORIGINAL 2 27
REPEAT 2 53 54 55
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