Basic information
- CAS
59252-39-0- Standard SMILES
CCCCCCCCCCCCCCCCCCC(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)n1- InChIKey
VXGYBQMZBBAOBJ-DRZCSJLFSA-N- Molecular formula
- C28H49N3O6
- Average molar mass
- 523.7 g/mol
- Monoisotopic mass
- 523.36213629
Names & identifiers
- Preferred name
- Cytosine, 1-beta-D-arabinofuranosyl-N(sup 4)-nonadecanoyl-
- IUPAC
- N-[1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]nonadecanamide
Names & synonyms
BRN 0730933CYTOSINE, 1-beta-D-ARABINOFURANOSYL-N(sup 4)-NONADECANOYL-1-beta-D-Arabinofuranosyl-N(sup 4)-nonadecanoylcytosineN(sup 4)-Nonadecanoyl-1-beta-D-arabinofuranosylcytosineDTXSID1020798259252-39-0RefChem:336410DTXCID60130473VXGYBQMZBBAOBJ-DRZCSJLFSA-NN4 -nonadecanoyl-1-beta-D-arabinofuranosylcytosine1-beta-D-Arabinofuranosyl-4-nonadecanamidopyrimidin-2(1H)-one
Database identifiers
- CAS
59252-39-0- PubChem CID
- 42986
- DTXSID
DTXSID10207982- Nikkaji
- J85.333J
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 20
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 729
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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