| | COMPOUND: C12662 | |
Entry |
|
Name |
|
Formula |
C42H69NO15
|
Exact mass |
827.4667
|
Mol weight |
827.99
|
Structure |
|
Remark |
|
Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C12662 Leucomycin A3
Prodrugs [br08324.html]
C12662
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
J ANTIINFECTIVES FOR SYSTEMIC USE
J01 ANTIBACTERIALS FOR SYSTEMIC USE
J01F MACROLIDES, LINCOSAMIDES AND STREPTOGRAMINS
J01FA Macrolides
J01FA07 Josamycin
D01235 Josamycin (JP18/USAN/INN)
Drug groups [BR:br08330]
Antibacterial
DG01551 Macrolide antibiotic
DG01876 16-Membered ring macrolide antibiotic
DG00604 Josamycin
D01235 Josamycin
Metabolizing enzyme inhibitor
DG02852 CYP3A/CYP3A4 inhibitor
DG01522 CYP3A4 inhibitor
DG00604 Josamycin
D01235 Josamycin
Antimicrobials [BR:br08307]
Antibacterials
Protein biosynthesis inhibitor
Macrolide
D01235 Josamycin (JP18/USAN/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D01235 Josamycin
D01235 Josamycin tablets
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D01235
Prodrugs [br08324.html]
D01235
|
Other DBs |
|
KCF data |
ATOM 58
1 C1y C 28.8525 -21.3205
2 C1y C 29.9591 -21.9679
3 O2a O 27.7503 -21.9679
4 C1y C 28.8525 -20.0492
5 C1y C 31.0779 -21.3205
6 N1c N 29.9591 -23.2460
7 C1y C 26.6494 -22.6041
8 O2x O 29.9591 -19.4130
9 C1a C 27.7561 -19.4130
10 C1y C 31.0779 -20.0492
11 O1a O 32.1857 -21.9679
12 C1a C 31.0666 -23.8811
13 C1a C 28.8582 -23.8811
14 C1x C 26.6494 -23.8754
15 O2x O 25.5305 -21.9679
16 O2a O 33.3097 -17.2385
17 C1z C 25.5305 -24.5227
18 C1y C 24.4239 -22.6041
19 C1y C 29.8973 -13.5819
20 C1y C 24.4239 -23.8754
21 C1a C 24.6677 -25.7434
22 O1a O 26.4284 -25.9025
23 C1a C 23.3276 -21.9679
24 C1y C 29.8918 -12.2701
25 C1y C 28.8372 -14.2465
26 O7a O 23.3276 -24.5227
27 C1x C 28.7503 -11.6283
28 C1b C 30.9870 -11.6226
29 C1y C 28.8429 -15.6264
30 O2a O 27.7238 -13.6158
31 C1y C 28.7503 -10.3402
32 C4a C 32.1003 -12.2533
33 C1x C 27.6314 -16.2170
34 C1y C 27.6256 -9.7040
35 C1a C 29.8512 -9.6984
36 O4a O 33.2012 -11.6057
37 C7x C 26.4727 -15.5752
38 C2x C 26.5247 -10.3402
39 O1a O 27.6256 -8.4335
40 O7x O 25.3155 -16.2115
41 O6a O 26.4727 -14.2972
42 C2x C 26.5247 -11.6283
43 C1y C 24.1740 -15.5176
44 C2x C 25.3945 -12.2701
45 C1x C 24.1572 -14.1662
46 C1a C 23.0494 -16.1312
47 C2x C 25.3775 -13.5650
48 C1a C 27.7134 -12.3437
49 C7a C 22.2251 -23.8973
50 C1b C 21.1286 -24.5447
51 O6a O 22.2824 -22.6312
52 C1c C 20.0262 -23.9260
53 C1a C 18.9391 -24.5714
54 C1a C 20.0107 -22.6621
55 O7a O 29.9347 -16.2960
56 C7a C 29.9359 -17.6450
57 O6a O 31.1047 -18.3184
58 C1a C 28.7683 -18.3204
BOND 60
1 10 16 1 #Up
2 14 17 1
3 15 18 1
4 19 16 1 #Down
5 17 20 1
6 17 21 1 #Down
7 17 22 1 #Up
8 18 23 1 #Down
9 19 24 1
10 19 25 1
11 20 26 1 #Up
12 24 27 1
13 24 28 1 #Down
14 25 29 1
15 25 30 1 #Down
16 27 31 1
17 28 32 1
18 29 33 1
19 31 34 1
20 31 35 1 #Down
21 32 36 2
22 33 37 1
23 34 38 1
24 34 39 1 #Down
25 37 40 1
26 37 41 2
27 38 42 2
28 40 43 1
29 42 44 1
30 43 45 1
31 43 46 1 #Down
32 44 47 2
33 8 10 1
34 18 20 1
35 45 47 1
36 30 48 1
37 1 2 1
38 26 49 1
39 1 3 1 #Down
40 49 50 1
41 1 4 1
42 49 51 2
43 2 5 1
44 50 52 1
45 2 6 1 #Up
46 7 3 1 #Up
47 4 8 1
48 4 9 1 #Up
49 5 10 1
50 5 11 1 #Down
51 52 53 1
52 6 12 1
53 52 54 1
54 29 55 1 #Down
55 6 13 1
56 55 56 1
57 7 14 1
58 56 57 2
59 7 15 1
60 56 58 1
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