| Entry |
|
|---|
| Name |
Aspoxicillin (JAN/INN);
ASPC;
Doyle (TN) |
|---|
| Formula |
C21H27N5O7S
|
|---|
| Exact mass |
493.1631
|
|---|
| Mol weight |
493.5334
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
|
|---|
| Remark |
|
|---|
| Efficacy |
Antibacterial, Cell wall biosynthesis inhibitor |
|---|
| Target |
penicillin binding protein |
|---|
| Pathway |
|
|---|
| Interaction |
|
|---|
| 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
J01CA Penicillins with extended spectrum
J01CA19 Aspoxicillin
D07469 Aspoxicillin (JAN/INN)
Drug groups [BR:br08330]
Antibacterial
DG01710 beta-Lactam antibiotic
DG01713 Penicillin skeleton group
DG01480 Penicillin
DG00533 Aspoxicillin
D07469 Aspoxicillin
DG01780 Extended spectrum penicillin
DG00533 Aspoxicillin
D07469 Aspoxicillin
Antimicrobials [BR:br08307]
Antibacterials
Cell wall biosynthesis inhibitor, beta-lactam
Extended spectrum penicillin
D07469 Aspoxicillin (JAN/INN)
Drug groups [BR:br08330]
Antibacterial
DG01710 beta-Lactam antibiotic
DG01713 Penicillin skeleton group
DG01480 Penicillin
DG00533 Aspoxicillin
DG01780 Extended spectrum penicillin
DG00533 Aspoxicillin
Antimicrobials abbreviations [BR:br08327]
Antibacterials
Cell wall biosynthesis inhibitor, beta-lactam
Extended spectrum penicillin
DG00533 Aspoxicillin
|
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| Other DBs |
|
|---|
| KCF data |
ATOM 34
1 C1y C 22.3758 -17.2046
2 C5x C 22.3758 -18.6035
3 N1y N 23.7747 -18.6035
4 C1y C 23.7747 -17.2046
5 C1y C 25.1037 -19.0232
6 C1z C 25.9430 -17.9041
7 S2x S 25.1037 -16.7850
8 C1a C 26.9222 -18.8833
9 C1a C 26.9222 -16.9249
10 C6a C 25.5933 -20.4221
11 O6a O 26.9922 -20.4221
12 O6a O 24.7539 -21.4713
13 N1b N 21.1868 -16.5052
14 C5a C 19.9977 -17.2046
15 O5x O 21.1868 -19.3030
16 O5a O 19.9977 -18.6035
17 C1c C 18.7387 -16.5052
18 C8y C 18.7387 -15.1063
19 C8x C 19.9977 -14.4069
20 C8x C 19.9977 -13.0080
21 C8y C 18.7387 -12.3085
22 C8x C 17.5496 -13.0080
23 C8x C 17.5496 -14.4069
24 N1b N 17.5496 -17.2046
25 C5a C 16.3606 -16.5052
26 C1c C 15.1016 -17.2046
27 O5a O 16.3606 -15.1063
28 C1b C 13.9125 -16.4353
29 O1a O 18.7387 -10.9096
30 N1a N 15.1016 -18.6035
31 C5a C 12.7234 -17.1347
32 N1b N 11.5344 -16.4353
33 C1a C 10.2754 -17.1347
34 O5a O 12.7235 -18.5336
BOND 36
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 #Down
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 18 23 1
26 24 25 1
27 25 26 1
28 17 24 1
29 25 27 2
30 26 28 1
31 21 29 1
32 26 30 1 #Down
33 28 31 1
34 31 32 1
35 32 33 1
36 31 34 2
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