Basic information
- Standard SMILES
Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1- InChIKey
UHDGCWIWMRVCDJ-UHFFFAOYSA-N- Molecular formula
- C9H13N3O5
- Average molar mass
- 243.22 g/mol
- Monoisotopic mass
- 243.08552052
Overview
1-β-D-Arabinofuranosylcytosine has been reported in Fritillaria taipaiensis, Fritillaria walujewii, and other organisms with data available.
Names & identifiers
- Preferred name
- 4-Amino-1-pentofuranosyl-2(1H)-pyrimidinone
- IUPAC
- 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Names & synonyms
688007-26-3RefChem:10702274-amino-1-pentofuranosyl-2(1h)-pyrimidinone[5',5''-2H2]cytidine478511-21-6[2'-13C]CYTIDINE.beta.-Arabinosylcytosine.beta.-Cytosine arabinoside.beta.-D-ArabinosylcytosineCytosine-.beta.-arabinoside1.beta.-D-ArabinosylcytosineMLS003389283
Show more names
Cytosine, .beta.-D-arabinoside1.beta.-Arabinofuranasylcytosine1.beta.-D-ArabinofuranosylcytosineCytosine, 1-.beta.-D-arabinosyl-Cytosine-.beta.-D-arabinofuranoside1-.beta.-D-ArabinofaranosylcytosineCylocideCytosine, 1-.beta.-D-arabinofuranosyl-
Database identifiers
- CAS
147-94-4、65-46-3、688007-26-3、7428-39-9- PubChem CID
- 596
- DTXSID
DTXSID80859078- ChEMBL
CHEMBL78
Properties
Computed structural properties
- XLogP
- -2.1
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 383
Experimental & physicochemical properties
DrugsPharmaceuticals
Related reactions
21 records
Linked notes
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