CHEBI:68855 - ioflupane I123

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ChEBI Name ioflupane I123
ChEBI ID CHEBI:68855
ChEBI ASCII Name ioflupane I(123)
Definition An azabicycloalkane that is ecgonine methyl ester in which the N-methyl group is replaced by 3-fluoropropyl and the 3β-hydroxy group is replaced by 4-(123I)iodophenyl. Used for the imaging of dopamine transporters in the brain of adult patients with potential Parkinsonian Syndromes.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H23FINO2
Net Charge 0
Average Mass 427.28470
Monoisotopic Mass 431.076
InChI InChI=1S/C18H23FINO2/c1-23-18(22)17-15(12-3-5-13(20)6-4-12)11-14-7-8-16(17)21(14)10-2-9-19/h3-6,14-17H,2,7-11H2,1H3/t14-,15+,16+,17-/m0/s1/i20-4
InChIKey HXWLAJVUJSVENX-HFIFKADTSA-N
SMILES [H][C@]12CC[C@]([H])([C@H]([C@H](C1)c1ccc([123I])cc1)C(=O)OC)N2CCCF
Roles Classification
Application(s): radioactive imaging agent

radiopharmaceutical
Any pharmaceutical compound containing a radioisotope.
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ChEBI Ontology
Outgoing ioflupane I123 (CHEBI:68855) has functional parent ecgonine (CHEBI:4743)
ioflupane I123 (CHEBI:68855) has role radioactive imaging agent (CHEBI:37336)
ioflupane I123 (CHEBI:68855) has role radiopharmaceutical (CHEBI:35232)
ioflupane I123 (CHEBI:68855) is a azabicycloalkane (CHEBI:38295)
ioflupane I123 (CHEBI:68855) is a methyl ester (CHEBI:25248)
ioflupane I123 (CHEBI:68855) is a organofluorine compound (CHEBI:37143)
IUPAC Name
methyl (1R,2S,3S,5S)-8-(3-fluoropropyl)-3-[4-(123I)iodophenyl]-8-azabicyclo[3.2.1]octane-2-carboxylate
INNs Sources
ioflupane (123I) WHO MedNet
ioflupane (123I) WHO MedNet
ioflupano (123I) WHO MedNet
ioflupanum (123I) WHO MedNet
Synonyms Sources
123I-FP-CIT ChemIDplus
123I-Ioflupane ChemIDplus
ioflupane (123I) ChEBI
Brand Name Source
Datscan KEGG DRUG
Database Links Databases
4230 DrugCentral
D10014 KEGG DRUG
Ioflupane_(123I) Wikipedia
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Registry Number Type Source
155798-07-5 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
22 February 2017