Basic information
- CAS
59252-35-6- Standard SMILES
CCCCCCCCCCCCCCC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)n1- InChIKey
KPDUJONFVNUHQT-TWHAJKEOSA-N- Molecular formula
- C24H41N3O6
- Average molar mass
- 467.6 g/mol
- Monoisotopic mass
- 467.29953604
Names & identifiers
- Preferred name
- Cytosine, 1-beta-D-arabinofuranosyl-N(sup 4)-pentadecanoyl-
- IUPAC
- N-[1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]pentadecanamide
- English name
- 1-β-D-Arabinofuranosyl-4-pentadecanoylaminopyrimidin-2(1H)-one
- Molecular formula
- C24H41N3O6
- Molecular weight
- 467.6
Names & synonyms
BRN 072681159252-35-6CYTOSINE, 1-beta-D-ARABINOFURANOSYL-N(sup 4)-PENTADECANOYL-1-beta-D-Arabinofuranosyl-N(sup 4)-pentadecanoylcytosineN(sup 4)-Pentadecanoyl-1-beta-D-arabinofuranosylcytosineDTXSID90207980RefChem:336411DTXCID401304711-beta-D-Arabinofuranosyl-4-pentadecanoylaminopyrimidin-2(1H)-oneDB-2503241-beta-D-Arabinofuranosyl-4-pentadecanamidopyrimidin-2(1H)-one1-β-D-Arabinofuranosyl-4-pentadecanoylaminopyrimidin-2(1H)-one
Show more names
Pentadecanamide, N-(1-β-D-arabinofuranosyl-1,2-dihydro-2-oxo-4-pyrimidinyl)-
Database identifiers
- CAS
59252-35-6- PubChem CID
- 42984
- DTXSID
DTXSID90207980
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 16
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 669
Physicochemical properties
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- pka
- 10.14 · 10.14±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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