5-Hydroxy-2'-deoxycytidine

HCID 477413CAS 52278-77-0

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: Nc1nc(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1O
InChIKey: CKZJTNZSBMVFSU-UBKIQSJTSA-N
Summenformel: C9H13N3O5
Durchschnittliche Molmasse: 243,22 g/mol
Monoisotopische Masse: 243,08552052

Überblick

a major oxidation product of 2'-deoxycytidine

Namen und Bezeichner

Bevorzugter Name: 5-Hydroxy-2'-deoxycytidine
IUPAC: 4-amino-5-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Englischer Name: 5-HYDROXY-2'-DEOXYCYTIDINE
Summenformel: C9H13N3O5
Molmasse: 243.22

Namen und Synonyme

5-Hydroxy-2'-deoxycytidine52278-77-02'-Deoxy-5-hydroxycytidine6JHE7FC4BXCytidine, 2'-deoxy-5-hydroxy-Oh-5-dCRefChem:1027355-Hydroxydeoxycytidine5-OHdCMFCD019378604-amino-5-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one4-amino-5-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one

Weitere Namen anzeigen

5-Oh-dcAids088694Aids-0886942’-deoxy-5-hydroxycytidine2’-deoxy-5-hydroxy-cytidin

UNII-6JHE7FC4BX5-HYDROXY-2-DEOXYCYTIDINECCRIS 82385-Hydroxydeoxycytidine'SCHEMBL529289CHEMBL217849DTXSID00966652CKZJTNZSBMVFSU-UBKIQSJTSA-N

Datenbank-Bezeichner

CAS: 52278-77-0
PubChem CID: 477413
DTXSID: DTXSID00966652
ChEMBL: CHEMBL217849
UNII: 6JHE7FC4BX
Nikkaji: J740.951F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -1,9
Polarare Oberfläche (TPSA): 129 Å²
H-Brücken-Donoren: 4
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 2
Schwere Atome: 17
Formalladung: 0
Komplexität: 394

Physikochemische Eigenschaften

Schmelzpunkt: 109 · 109-110°C
storage temp.: -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
Löslichkeit: Methanol (Slightly), Water (Slightly)
Aggregatzustand: Solid
Farbe: White to Off-White
Stabilität: Hygroscopic

Chemie und Industrie

Anwendungen

Verwenden5-Hydroxy-2’-deoxycytidine have been used as a substrate for uracil DNA N-glycosylase and has been used to study the oxidation of DNA due to exposure to reactive oxygen species.