| Entry |
|
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| Name |
Erythromycin thiocyanate;
Erythrocin (TN) |
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| Formula |
C37H67NO13. CHNS
|
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| Exact mass |
792.4442
|
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| Mol weight |
793.02
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| Structure |
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| Simcomp |
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| Class |
Antibacterial
DG01551 Macrolide antibiotic
DG01874 14-membered ring macrolide antibiotic
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
Metabolizing enzyme inhibitor
DG02852 CYP3A/CYP3A4 inhibitor
Transporter inhibitor
DG01622 ABCB1 inhibitor
|
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| Remark |
| Product (DG00436): | D00140<JP/US> D01361<JP/US> D02009<JP/US> D02184<JP> |
|
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| Efficacy |
Antibacterial, Protein biosynthesis inhibitor |
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| Target |
50S ribosomal subunit |
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| Pathway |
|
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| Metabolism |
|
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| Interaction |
CYP inhibition: CYP3A [HSA: 1576 1577 1551]
Transporter inhibition: ABCB1 [HSA: 5243]
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| Structure map |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
D DERMATOLOGICALS
D10 ANTI-ACNE PREPARATIONS
D10A ANTI-ACNE PREPARATIONS FOR TOPICAL USE
D10AF Antiinfectives for treatment of acne
D10AF02 Erythromycin
D07909 Erythromycin thiocyanate
J ANTIINFECTIVES FOR SYSTEMIC USE
J01 ANTIBACTERIALS FOR SYSTEMIC USE
J01F MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
J01FA Macrolides
J01FA01 Erythromycin
D07909 Erythromycin thiocyanate
S SENSORY ORGANS
S01 OPHTHALMOLOGICALS
S01A ANTIINFECTIVES
S01AA Antibiotics
S01AA17 Erythromycin
D07909 Erythromycin thiocyanate
Drug groups [BR:br08330]
Antibacterial
DG01551 Macrolide antibiotic
DG01874 14-membered ring macrolide antibiotic
DG00436 Erythromycin
D07909 Erythromycin thiocyanate
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG00436 Erythromycin
D07909 Erythromycin thiocyanate
Metabolizing enzyme inhibitor
DG02852 CYP3A/CYP3A4 inhibitor
DG00436 Erythromycin
D07909 Erythromycin thiocyanate
Transporter inhibitor
DG01622 ABCB1 inhibitor
DG00436 Erythromycin
D07909 Erythromycin thiocyanate
Antimicrobials [BR:br08307]
Antibacterials
Protein biosynthesis inhibitor
Macrolide
D07909 Erythromycin thiocyanate
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D07909
Drug transporters
D07909
Drug groups [BR:br08330]
Antibacterial
DG01551 Macrolide antibiotic
DG01874 14-membered ring macrolide antibiotic
DG00436 Erythromycin
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG00436 Erythromycin
Metabolizing enzyme inhibitor
DG02852 CYP3A/CYP3A4 inhibitor
DG00436 Erythromycin
Transporter inhibitor
DG01622 ABCB1 inhibitor
DG00436 Erythromycin
Antimicrobials abbreviations [BR:br08327]
Antibacterials
Protein biosynthesis inhibitor
Macrolide
DG00436 Erythromycin
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 54
1 C1y C 17.3600 -16.5900
2 C1z C 17.3600 -15.2600
3 C1y C 16.1700 -17.2900
4 O2a O 19.3200 -17.2900
5 C1x C 16.1700 -14.5600
6 O1a O 18.4100 -14.2800
7 C1a C 18.6200 -15.6800
8 C1y C 16.1700 -18.6200
9 C1a C 15.1900 -16.2400
10 C1y C 20.9300 -16.5900
11 C1y C 16.1700 -13.1600
12 O2a O 16.9400 -20.0200
13 C1y C 14.9800 -19.3200
14 C1y C 22.1200 -17.2900
15 O2x O 20.9300 -15.2600
16 C5x C 14.9800 -12.5300
17 C1a C 17.3600 -12.5300
18 C1y C 18.4100 -20.4400
19 C7x C 13.7900 -18.6200
20 C1a C 14.9800 -20.7200
21 C1y C 23.2400 -16.6600
22 O1a O 22.0500 -18.6900
23 C1y C 22.1200 -14.5600
24 C1y C 13.7900 -13.1600
25 O5x O 14.9800 -11.1300
26 C1x C 18.4100 -21.7700
27 O2x O 19.6000 -19.7400
28 O7x O 13.7900 -17.2900
29 O6a O 12.7400 -19.6000
30 C1x C 23.3100 -15.2600
31 N1c N 24.4300 -17.3600
32 C1a C 22.1200 -13.2300
33 C1y C 13.7900 -14.5600
34 C1a C 12.6700 -12.5300
35 C1z C 19.6000 -22.4700
36 C1y C 20.7900 -20.4400
37 C1y C 12.6700 -16.5900
38 C1z C 12.6700 -15.2600
39 O1a O 14.9800 -15.2600
40 C1y C 20.7900 -21.7700
41 O2a O 19.6000 -23.8000
42 C1a C 21.0700 -23.4500
43 C1a C 21.9800 -19.7400
44 C1b C 11.4800 -17.2900
45 C1a C 11.4100 -15.8200
46 O1a O 11.4100 -14.5600
47 O1a O 21.9800 -22.4700
48 C1a C 20.7200 -24.7800
49 C1a C 11.4800 -18.4100
50 C1a C 25.6900 -16.5900
51 C1a C 24.4300 -18.6900
52 C3b C 31.6400 -18.1300
53 N3a N 33.0400 -18.1300
54 S1a S 30.2400 -18.1300
BOND 55
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Up
6 2 7 1 #Down
7 3 8 1
8 3 9 1 #Down
9 10 4 1 #Down
10 5 11 1
11 8 12 1 #Down
12 8 13 1
13 10 14 1
14 10 15 1
15 11 16 1
16 11 17 1 #Down
17 18 12 1 #Down
18 13 19 1
19 13 20 1 #Up
20 14 21 1
21 14 22 1 #Up
22 15 23 1
23 16 24 1
24 16 25 2
25 18 26 1
26 18 27 1
27 19 28 1
28 19 29 2
29 21 30 1
30 21 31 1 #Down
31 23 32 1 #Down
32 24 33 1
33 24 34 1 #Up
34 26 35 1
35 27 36 1
36 28 37 1
37 33 38 1
38 33 39 1 #Up
39 35 40 1
40 35 41 1 #Down
41 35 42 1
42 36 43 1 #Up
43 37 44 1 #Down
44 38 45 1 #Down
45 38 46 1 #Up
46 40 47 1 #Down
47 41 48 1
48 44 49 1
49 23 30 1
50 36 40 1
51 37 38 1
52 31 50 1
53 31 51 1
54 52 53 3
55 52 54 1
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