| | COMPOUND: C06683 | |
Entry |
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Name |
|
Formula |
C18H18N8O7S3
|
Exact mass |
554.0461
|
Mol weight |
554.5799
|
Structure |
|
Remark |
|
Brite |
Compounds with biological roles [BR:br08001]
Antibiotics
beta-Lactams
Cephems
C06683 Ceftriaxone
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
J ANTIINFECTIVES FOR SYSTEMIC USE
J01 ANTIBACTERIALS FOR SYSTEMIC USE
J01D OTHER BETA-LACTAM ANTIBACTERIALS
J01DD Third-generation cephalosporins
J01DD04 Ceftriaxone
D07659 Ceftriaxone (INN)
Drug groups [BR:br08330]
Antibacterial
DG01710 beta-Lactam antibiotic
DG01714 Cephalosporin skeleton group
DG01488 Cephem
DG00573 Ceftriaxone
D07659 Ceftriaxone
DG01776 Third-generation cephalosporin
DG00573 Ceftriaxone
D07659 Ceftriaxone
DG01804 Oxyimino beta-lactam
DG00573 Ceftriaxone
D07659 Ceftriaxone
Antimicrobials [BR:br08307]
Antibacterials
Cell wall biosynthesis inhibitor, beta-lactam
Third-generation cephalosporin
D07659 Ceftriaxone (INN)
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Other DBs |
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KCF data |
ATOM 36
1 C1y C 24.7786 -18.1994
2 N1y N 24.7786 -19.5293
3 C2y C 26.0383 -20.2292
4 C2y C 27.2282 -19.5293
5 C1x C 27.2282 -18.1994
6 S2x S 26.0383 -17.4994
7 C1y C 23.3787 -18.1994
8 C5x C 23.3787 -19.5293
9 N1b N 22.1888 -17.4994
10 C5a C 20.9989 -18.1994
11 O5a O 20.9989 -19.5293
12 O5x O 22.1888 -20.2292
13 C2c C 19.8090 -17.4994
14 C1b C 28.4181 -20.2992
15 C8y C 18.5491 -18.1994
16 C8x C 17.4292 -17.3595
17 S2x S 16.3093 -18.1994
18 C8y C 16.7293 -19.5992
19 N5x N 18.1292 -19.5992
20 N2b N 19.8090 -16.0297
21 C6a C 26.0383 -21.6291
22 O6a O 27.2282 -22.3990
23 O6a O 24.7786 -22.3290
24 S2a S 29.6080 -19.5992
25 C8y C 30.7979 -20.2992
26 N1a N 15.8894 -20.7191
27 N5x N 30.7979 -21.6991
28 C8y C 31.9878 -22.3990
29 C8y C 33.2477 -21.6991
30 N4x N 33.2477 -20.2992
31 N4y N 31.9878 -19.5992
32 O5x O 31.9878 -23.7989
33 O5x O 34.4376 -22.3990
34 C1a C 31.9878 -18.1994
35 O2a O 21.0162 -15.3193
36 C1a C 21.0162 -13.9193
BOND 39
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1
8 7 8 1
9 2 8 1
10 7 9 1 #Up
11 9 10 1
12 10 11 2
13 8 12 2
14 10 13 1
15 4 14 1
16 13 15 1
17 15 16 2
18 16 17 1
19 17 18 1
20 18 19 2
21 15 19 1
22 13 20 2
23 3 21 1
24 21 22 1
25 21 23 2
26 14 24 1
27 24 25 1
28 18 26 1
29 25 27 2
30 27 28 1
31 28 29 1
32 29 30 1
33 30 31 1
34 25 31 1
35 28 32 2
36 29 33 2
37 31 34 1
38 20 35 1
39 35 36 1
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