IOXILAN

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Trade Names:
Synonyms:
Status: Approved (1995)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: V08AB12
UNII: A4YJ7J11TG

Structure
InChI Key UUMLTINZBQPNGF-UHFFFAOYSA-N
Smile CC(=O)N(CC(O)CO)c1c(I)c(C(=O)NCCO)c(I)c(C(=O)NCC(O)CO)c1I
InChI
InChI=1S/C18H24I3N3O8/c1-8(28)24(5-10(30)7-27)16-14(20)11(17(31)22-2-3-25)13(19)12(15(16)21)18(32)23-4-9(29)6-26/h9-10,25-27,29-30H,2-7H2,1H3,(H,22,31)(H,23,32)

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H24I3N3O8
Molecular Weight 791.11
AlogP -0.99
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 7.0
Number of Rotational Bond 11.0
Polar Surface Area 179.66
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 32.0

Pharmacology

Action Mechanism of Action Reference
None Diagnostic agent FDA

Related Entries

MCS

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Skin and subcutaneous tissue disorders
21.41
Immune system disorders
18.87
Respiratory, thoracic and mediastinal disorders
12.39
Gastrointestinal disorders
11.83
Cardiac disorders
7.89
Vascular disorders
6.48
Injury, poisoning and procedural complications
5.92
General disorders and administration site conditions
4.51
Nervous system disorders
3.1
Psychiatric disorders
2.54

Cross References

Resources Reference
CAS NUMBER 107793-72-6
ChEBI 135884
ChEMBL CHEMBL1201075
DrugBank DB09135
DrugCentral 1473
EPA CompTox DTXSID0048717
FDA SRS A4YJ7J11TG
PubChem 3743
SureChEMBL SCHEMBL25634
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