(3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl)methyl dihydrogen phosphate
Basic information
- CAS
365-07-1- Standard SMILES
Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O- InChIKey
GYOZYWVXFNDGLU-UHFFFAOYSA-N- Molecular formula
- C10H15N2O8P
- Average molar mass
- 322.21 g/mol
- Monoisotopic mass
- 322.05660244
Overview
[3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate is a pyrimidine 2'-deoxyribonucleoside monophosphate.
Names & identifiers
- Preferred name
- (3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl)methyl dihydrogen phosphate
- IUPAC
- [3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate
Names & synonyms
[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate(3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl)methyl dihydrogen phosphateRefChem:1050105Thymidine 5'MPthymidine 5'-monophos-phateSCHEMBL16092807DTXSID10861902CHEBI:181566NSC46713L0012401-(2-Deoxy-5-O-phosphonopentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
365-07-1- PubChem CID
- 1139
- DTXSID
DTXSID10861902- ChEBI
CHEBI:181566
Properties
Computed structural properties
- XLogP
- -2.8
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 529
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Related reactions
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Compound notes
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