N-(1,3-bis((4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)propan-2-yl)-2-((10,17-dioxo-21-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-3,6-dioxa-9,16-diazahenicosyl)oxy)-4-(3-(trifluoromethyl)-3H-diazirin-3-yl)benzamide CAS 207971-25-3

Purity 97%+In StockPharmaceutical Standards
CAS No.207971-25-3
Molecular FormulaC46H70F3N7O19S
Molecular Weight1114.14 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

N-(1,3-bis((4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)propan-2-yl)-2-((10,17-dioxo-21-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-3,6-dioxa-9,16-diazahenicosyl)oxy)-4-(3-(trifluoromethyl)-3H-diazirin-3-yl)benzamide CAS 207971-25-3 chemical structure

Description

The occurrence of N-(1,3-bis((4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)propan-2-yl)-2-((10,17-dioxo-21-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-3,6-dioxa-9,16-diazahenicosyl)oxy)-4-(3-(trifluoromethyl)-3H-diazirin-3-yl)benzamide is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

N-(1,3-bis((4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)propan-2-yl)-2-((10,17-dioxo-21-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-3,6-dioxa-9,16-diazahenicosyl)oxy)-4-(3-(trifluoromethyl)-3H-diazirin-3-yl)benzamide (CAS 207971-25-3), molecular formula C46H70F3N7O19S and molecular weight 1114.14 g/mol, is a CATO reference standard with documented purity and traceability.

The molecular framework of N-(1,3-bis((4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)propan-2-yl)-2-((10,17-dioxo-21-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)-3,6-dioxa-9,16-diazahenicosyl)oxy)-4-(3-(trifluoromethyl)-3H-diazirin-3-yl)benzamide (C46H70F3N7O19S) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC46H70F3N7O19S
Molecular Weight1114.14 g/mol
Purity97%+
StorageStore in a cool place (≤25°C), protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)14.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2016
Halogen ContentF-containing
Nitrogen Atoms7
Sulfur Atoms1

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