5-Fluorouridine

HCID 9427CAS 316-46-1

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Grundinformationen

Standard-SMILES: O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1F
InChIKey: FHIDNBAQOFJWCA-UAKXSSHOSA-N
Summenformel: C9H11FN2O6
Durchschnittliche Molmasse: 262,19 g/mol
Monoisotopische Masse: 262,06011429

Überblick

5-fluorouridine is an organofluorine compound that is uridine bearing a fluoro substituent at position 5 on the uracil ring. It has a role as a mutagen. It is a member of uridines and an organofluorine compound.

Namen und Bezeichner

Bevorzugter Name: 5-Fluorouridine
IUPAC: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoropyrimidine-2,4-dione

Namen und Synonyme

5-Fluorouridine316-46-15-Fur5-Fluoro-uridine5-Fluorouracil 1beta-D-ribofuranosideDTXSID40403971-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoropyrimidine-2,4-dioneNSC-1466044K0M952561CHEBI:401541-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl)-5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione

Weitere Namen anzeigen

1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl)-5-fluoropyrimidine-2,4-dioneRefChem:102673DTXCID2020397206-260-3Uridine, 5-fluoro-1-((2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-fluoropyrimidine-2,4(1H,3H)-dione5-Fluoro Uridinefluorouridine

Datenbank-Bezeichner

CAS: 316-46-1
PubChem CID: 9427
DTXSID: DTXSID4040397
ChEMBL: CHEMBL54918
ChEBI: CHEBI:40154
UNII: 4K0M952561
EC Number: 206-260-3
Nikkaji: J36.572F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -1,7
Polarare Oberfläche (TPSA): 119 Å²
H-Brücken-Donoren: 4
H-Brücken-Akzeptoren: 7
Frei drehbare Bindungen: 2
Schwere Atome: 18
Formalladung: 0
Komplexität: 414

Experimentelle und physikochemische Eigenschaften

Drugs · 2 Einträge

Pharmaceuticals -> Metabolite of Fluorouracil

Pharmaceuticals -> Listed in ZINC15

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.