Entry
Name
Gadofosveset trisodium (USAN); Ablavar (TN)
Formula
C33H38N3O14P. 3Na. Gd. H2O
Exact mass
976.1131
Mol weight
975.8749
Structure
Mol file KCF file DB search
Simcomp
Neighbor
Remark
Efficacy
Diagnostic aid (contrast medium, angiographic)
Comment
Diagnostic contrast agent for vascular enhancement of MRI scans
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303 ]
V VARIOUS
V08 CONTRAST MEDIA
V08C MAGNETIC RESONANCE IMAGING CONTRAST MEDIA
V08CA Paramagnetic contrast media
V08CA11 Gadofosveset
D04286 Gadofosveset trisodium (USAN)
New drug approvals in the USA [br08319.html ]
New molecular entities and new therapeutic biological products
D04286
New drug approvals in the USA, Europe and Japan [br08328.html ]
Approval dates by FDA, EMA and PMDA
D04286
BRITE hierarchy
Other DBs
LinkDB
All DBs
KCF data
Show ATOM 56
1 Z Gd 22.1900 -28.9100 #3+
2 Z Na 32.9000 -31.2200 #+
3 C6a C 21.0700 -25.5500
4 O6a O 19.8100 -26.2500 #-
5 O6a O 21.0700 -24.1500
6 C1b C 22.4700 -25.5500
7 O6a O 18.6200 -28.3500 #-
8 C6a C 18.6200 -29.7500
9 C1b C 19.3200 -30.9400
10 C1b C 21.0700 -32.5500
11 N1c N 22.2600 -31.8500
12 O6a O 19.8800 -30.4500 #-
13 C6a C 19.8800 -31.8500
14 C1b C 23.5200 -32.5500
15 C1b C 24.7100 -31.8500
16 N1c N 24.7100 -30.4500
17 C1b C 25.9000 -29.7500
18 C1c C 25.9000 -28.3500
19 N1c N 24.7100 -27.6500
20 C1b C 24.7100 -26.2500
21 C6a C 23.5200 -25.5500
22 O6a O 22.2600 -26.2500 #-
23 O6a O 17.2900 -30.1000
24 O6a O 18.6200 -32.5500
25 C1b C 25.9000 -31.1500
26 C6a C 27.0900 -30.4500
27 O6a O 28.2800 -31.1500
28 O6a O 27.0900 -29.0500 #-
29 O6a O 23.5200 -24.1500
30 C1b C 27.0900 -27.6500
31 O2b O 28.3500 -28.3500
32 P1b P 29.5400 -27.6500
33 O2b O 30.7300 -28.3500
34 C1y C 31.9900 -27.6500
35 C1x C 33.1800 -28.3500
36 C1x C 34.3700 -27.6500
37 C1z C 34.3700 -26.2500
38 C1x C 33.1800 -25.5500
39 C1x C 31.9900 -26.2500
40 C8y C 35.0700 -25.0600
41 C8y C 35.6300 -26.9500
42 C8x C 36.4700 -25.0600
43 C8x C 37.1700 -23.8000
44 C8x C 36.4700 -22.6100
45 C8x C 35.0700 -22.6100
46 C8x C 34.3700 -23.8000
47 C8x C 35.6300 -28.3500
48 C8x C 36.8200 -29.0500
49 C8x C 38.0100 -28.3500
50 C8x C 38.0100 -26.9500
51 C8x C 36.8200 -26.2500
52 O1c O 29.5400 -26.2500 #-
53 O1c O 29.5400 -29.0500
54 O0 O 17.3600 -26.3200
55 Z Na 32.9000 -31.2200 #+
56 Z Na 32.9000 -31.2200 #+
BOND 53
1 3 4 1
2 3 5 2
3 3 6 1
4 7 8 1
5 8 9 1
6 10 11 1
7 12 13 1
8 10 13 1
9 11 14 1
10 14 15 1
11 15 16 1
12 16 17 1
13 17 18 1
14 18 19 1
15 19 20 1
16 20 21 1
17 21 22 1
18 9 11 1
19 8 23 2
20 13 24 2
21 16 25 1
22 25 26 1
23 26 27 2
24 26 28 1
25 6 19 1
26 21 29 2
27 18 30 1
28 30 31 1
29 31 32 1
30 32 33 1
31 33 34 1
32 34 35 1
33 35 36 1
34 36 37 1
35 37 38 1
36 38 39 1
37 34 39 1
38 37 40 1
39 37 41 1
40 40 42 2
41 42 43 1
42 43 44 2
43 44 45 1
44 45 46 2
45 40 46 1
46 41 47 2
47 47 48 1
48 48 49 2
49 49 50 1
50 50 51 2
51 41 51 1
52 32 52 1
53 32 53 2
BRACKET 1 31.8500 -32.2000 31.8500 -30.1700
1 34.5100 -30.1700 34.5100 -32.2000
1 3
ORIGINAL 1 2
REPEAT 1 55 56