117627-12-0

Basic information

• Product Name: 2-[[(2R,3S,4S,5R)-5-(6-amino-5-bromo-2-oxo-3,6-dihydro-1H-pyridin-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid
• CAS NO: 117627-12-0
• Molecular Formula: C₁₂H₁₈BrN₂O₉P
• Molecular Weight: 445.1571
• Mol File: 117627-12-0.mol
• Article Data: 0

Chemical Properties

• Density: 1.883g/cm³
• Refractive Index: 1.633
• CAS DataBase Reference: 2-[[(2R,3S,4S,5R)-5-(6-amino-5-bromo-2-oxo-3,6-dihydro-1H-pyridin-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 2-[[(2R,3S,4S,5R)-5-(6-amino-5-bromo-2-oxo-3,6-dihydro-1H-pyridin-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid(117627-12-0)
• EPA Substance Registry System: 2-[[(2R,3S,4S,5R)-5-(6-amino-5-bromo-2-oxo-3,6-dihydro-1H-pyridin-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid(117627-12-0)

Safety Data

• Hazardous Substances Data: 117627-12-0(Hazardous Substances Data)

Usage

Molecular structure

2-[[(2R,3S,4S,5R)-5-(6-amino-5-bromo-2-oxo-3,6-dihydro-1H-pyridin-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]acetic acid is a complex organic compound with a specific three-dimensional arrangement of atoms.

Phosphoryl group

The compound contains a phosphoryl group (-PO3H2), which is a common functional group in biological molecules, such as nucleotides and proteins. This group can participate in various biochemical reactions, including phosphorylation and energy transfer.

Acetic acid moiety

The compound also includes an acetic acid group (-COOH), which is a carboxylic acid found in various organic compounds. It can form hydrogen bonds and participate in acid-base reactions, which may influence the compound's solubility and reactivity.

Tetrahydrofuran ring

The structure contains a tetrahydrofuran ring, which is a six-membered heterocyclic ring with one oxygen atom. This ring system can provide structural rigidity and stability to the compound, as well as offer potential binding sites for other molecules.

Hydroxyl and methoxy groups

The compound has hydroxyl (-OH) and methoxy (-OCH3) groups attached to the tetrahydrofuran ring. These functional groups can form hydrogen bonds and engage in various interactions with other molecules, which may affect the compound's solubility, stability, and biological activity.

Amino and bromo functional groups

The compound features an amino group (-NH2) and a bromo group (-Br) attached to a pyridin ring. The amino group can participate in hydrogen bonding, while the bromo group can impart unique chemical and physical properties to the compound, such as increased lipophilicity and potential electrophilic reactivity.

Potential biological activity

Given the presence of various functional groups and structural features, this compound may have potential biological activity, possibly involving processes such as phosphorylation, DNA or RNA processing, or other cellular signaling pathways.

Further study required

To fully understand the properties and potential applications of this compound, additional research and experimentation would be necessary, including in vitro and in vivo testing, as well as structural and functional analyses.