IODOHIPPURATE SODIUM I 131

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 9BRV734R3E

Structure
InChI Key XYITYKDGJLHYPW-UDYUCQKZSA-M
Smile O=C([O-])CNC(=O)c1ccccc1[131I].[Na+]
InChI
InChI=1S/C9H8INO3.Na/c10-7-4-2-1-3-6(7)9(14)11-5-8(12)13;/h1-4H,5H2,(H,11,14)(H,12,13);/q;+1/p-1/i10+4;

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H7INNaO3
Molecular Weight 331.06
AlogP 1.11
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 66.4
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 14.0

Cross References

Resources Reference
ChEBI 134740
ChEMBL CHEMBL1200763
DrugBank DB09382
EPA CompTox DTXSID90236816
FDA SRS 9BRV734R3E
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