Basic information
- CAS
17140-71-5- Standard SMILES
O.O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1I- InChIKey
JWEOOFXTRSOJNN-VWZUFWLJSA-N- Molecular formula
- C9H13IN2O6
- Average molar mass
- 372.11 g/mol
- Monoisotopic mass
- 371.98183
Names & identifiers
- Preferred name
- Idoxuridine monohydrate
- IUPAC
- 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione;hydrate
- English name
- 5-Iodo-2'-deoxyuridine (hydrate)
- Molecular formula
- C9H13IN2O6
- Molecular weight
- 372.12
Names & synonyms
IDOXURIDINE MONOHYDRATE17140-71-5UNII-7E78KL7PVW7E78KL7PVWUridine, 2'-deoxy-5-iodo-, monohydrateDTXSID50169090RefChem:147701DTXCID3091581Idoxuridine (hydrate)5-Iodo-2'-deoxyuridine (hydrate)IDOXURIDINE HYDRATEorb1688543
Show more names
URIDINE,2'-DEOXY-5-IODO-, MONOHYDRATE (8CI,9CI)1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione:hydrate
HY-B0307A1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione,hydrate2'-Deoxy-5-iodouridine--water (1/1)1-((2R,4S,5R)-4-Hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-iodopyrimidine-2,4(1h,3h)-dione hydrateDA-49040CS-0009289Q272681385-Iodo-2-deoxyuridine (hydrate);IdUrd (hydrate);5-IUdR (hydrate)
Database identifiers
- CAS
17140-71-5- PubChem CID
- 28330
- DTXSID
DTXSID50169090- UNII
- 7E78KL7PVW
Properties
Computed structural properties
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 386
Physicochemical properties
- FDA UNII
- 7 E78KL7PVW · 7E78KL7PVW
Chemistry & industry
Applications
UsesIdoxuridine (5-Iodo-2′-deoxyuridine, 5-IUdR, IdUrd) hydrate is an iodinated thymidine analogue that competitively inhibits phosphorylases. Idoxuridine can inhibit viral activity, particularly viral eye infections, including herpes simplex keratitis, by inhibiting DNA polymerase and affecting viral replication. Idoxuridine against feline herpesvirus has the IC50 value of 4.3 μM[1].
Suppliers4 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…