Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
V VARIOUS
V08 CONTRAST MEDIA
V08A X-RAY CONTRAST MEDIA, IODINATED
V08AA Watersoluble, nephrotropic, high osmolar X-ray contrast media
V08AA01 Diatrizoic acid
D02240 Diatrizoic acid (USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D02240 Amidotrizoic acid
Other DBs
CAS:
117-96-4
PubChem:
7849299
ChEBI:
53691
LigandBox:
D02240
NIKKAJI:
J5.294I
KCF data
ATOM 20
1 C8y C 16.0414 -14.2626
2 C8y C 16.0414 -12.8624
3 C8y C 17.2550 -14.9627
4 N1b N 14.8279 -14.9627
5 C8y C 17.2550 -12.1624
6 X I 14.8220 -12.1565
7 C8y C 18.4685 -14.2685
8 X I 17.2490 -16.3629
9 C5a C 13.6143 -14.2743
10 C8y C 18.4685 -12.8683
11 C6a C 17.2550 -10.7622
12 N1b N 19.6821 -14.9570
13 C1a C 12.4125 -14.9686
14 O5a O 13.6085 -12.8683
15 X I 19.6821 -12.1508
16 O6a O 16.0414 -10.0621
17 O6a O 18.4685 -10.0621
18 C5a C 20.8896 -14.2569
19 C1a C 22.0973 -14.9510
20 O5a O 20.8839 -12.8566
BOND 20
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 7 12 1
12 9 13 1
13 9 14 2
14 10 15 1
15 11 16 2
16 11 17 1
17 12 18 1
18 18 19 1
19 18 20 2
20 7 10 2