FLUOROFURANYLNORPROGESTERONE F-18

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Synonyms
Status
Molecule Category Free-form
UNII 3I798OGQ8B

Structure

InChI Key VJKRBRUNEOHPBS-JQKUZGBFSA-N
Smiles C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1C[C@H]1O[C@@H](c3ccco3)O[C@]12C(=O)C[18F]
InChI
InChI=1S/C25H29FO5/c1-24-9-8-17-16-7-5-15(27)11-14(16)4-6-18(17)19(24)12-22-25(24,21(28)13-26)31-23(30-22)20-3-2-10-29-20/h2-3,10-11,16-19,22-23H,4-9,12-13H2,1H3/t16-,17+,18+,19-,22+,23+,24-,25+/m0/s1/i26-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H29FO5
Molecular Weight 427.5
AlogP 4.72
Hydrogen Bond Acceptor 5.0
Number of Rotational Bond 3.0
Polar Surface Area 65.74
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 31.0

Cross References

Resources Reference
ChEMBL CHEMBL4297379
DrugBank DB15282
FDA SRS 3I798OGQ8B
CONTENTS