IOXAGLATE SODIUM

Search structure
Synonyms:
Status: Approved (1985)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: HQ43CN02U9

Structure
InChI Key MBVDCEVFLAONHO-UHFFFAOYSA-M
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.[Na+]
InChI
InChI=1S/C24H21I6N5O8.Na/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);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H20I6N5NaO8
Molecular Weight 1290.87
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

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL1200743
EPA CompTox DTXSID40218187
FDA SRS HQ43CN02U9
PubChem 23688359
SureChEMBL SCHEMBL492669
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