IOXAGLIC ACID

Search structure
Synonyms:
Status: Approved (1985)
Entry Type: Small molecule
Molecule Category: Parent
ATC: V08AB03
UNII: Z40X7EI2AF

Structure
InChI Key TYYBFXNZMFNZJT-UHFFFAOYSA-N
Smile CNC(=O)c1c(I)c(C(=O)NCC(=O)Nc2c(I)c(C(=O)O)c(I)c(C(=O)NCCO)c2I)c(I)c(N(C)C(C)=O)c1I
InChI
InChI=1S/C24H21I6N5O8/c1-7(37)35(3)20-17(29)10(21(39)31-2)13(25)11(18(20)30)23(41)33-6-8(38)34-19-15(27)9(22(40)32-4-5-36)14(26)12(16(19)28)24(42)43/h36H,4-6H2,1-3H3,(H,31,39)(H,32,40)(H,33,41)(H,34,38)(H,42,43)

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H21I6N5O8
Molecular Weight 1268.88
AlogP None
Hydrogen Bond Acceptor None
Hydrogen Bond Donor None
Number of Rotational Bond None
Polar Surface Area None
Molecular species None
Aromatic Rings None
Heavy Atoms None

Pharmacology

Action Mechanism of Action Reference
None Diagnostic
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- - - -
Enzyme Transferase
- - - - 11.8
Epigenetic regulator Eraser Histone deacetylase HDAC class IIb
- - - - -18.11--1.48

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 31718
ChEMBL CHEMBL1201291
DrugBank DB09313
DrugCentral 1472
EPA CompTox DTXSID5023166
FDA SRS Z40X7EI2AF
PubChem 3742
SureChEMBL SCHEMBL38073
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