1-[6-(2-azatricyclo[10.4.0.0⁴⁹]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl)-6-oxo-hexanoyl]oxy-2,5-dioxo-pyrrolidine-3-sulfonic acid CAS 1400302-73-9
| CAS No. | 1400302-73-9 |
| Molecular Formula | C25H34N2O8S |
| Molecular Weight | 522.61 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 522.61 g/mol gives 1-[6-(2-azatricyclo[10.4.0.0⁴⁹]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl)-6-oxo-hexanoyl]oxy-2,5-dioxo-pyrrolidine-3-sulfonic acid distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
1-[6-(2-azatricyclo[10.4.0.0⁴⁹]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl)-6-oxo-hexanoyl]oxy-2,5-dioxo-pyrrolidine-3-sulfonic acid (CAS 1400302-73-9), molecular formula C25H34N2O8S and molecular weight 522.61 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 1-[6-(2-azatricyclo[10.4.0.0⁴⁹]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl)-6-oxo-hexanoyl]oxy-2,5-dioxo-pyrrolidine-3-sulfonic acid (C25H34N2O8S) contains a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 10.0, corresponding to approximately 10 ring(s) or double-bond equivalent(s). With a molecular weight of 522.61 g/mol, it falls into the moderately-high-molecular-weight range. 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.
CATO manufactures 1-[6-(2-azatricyclo[10.4.0.0⁴⁹]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl)-6-oxo-hexanoyl]oxy-2,5-dioxo-pyrrolidine-3-sulfonic acid under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C25H34N2O8S |
| Molecular Weight | 522.61 g/mol |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°C), protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening |
| Degree of Unsaturation (DBE) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1991 |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related azatricyclo Standards
- 1-{2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl}-2-[bis(prop-2-en-1-yl)amino]ethan-1-one (CAS 858425-24-8)
- 5-(2-azatricyclo[10.4.0.0⁴⁹]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl)-5-oxo-pentanoic acid (CAS 1207355-31-4)
- 1-{2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl}-2-bromoethan-1-one (CAS 43170-50-9)
- 1-{2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl}-2-(diethylamino)ethan-1-one (CAS 858425-20-4)
- 2-oxo-1-azatricyclo[6.3.1.0^{4,12}]dodeca-4(12),5,7-triene-6-sulfonyl chloride (CAS 1267401-95-5)
- 11-Azatricyclo[7.3.1.02,7]trideca-2,4,6-triene-9-carboxylic acid ethyl ester 1250997-42-2 AM803089 (CAS 1250997-42-2)
- (11-oxo-1-azatricyclo[6.3.1.0⁴¹²]dodeca-4(12),5,7-trien-6-yl) acetate (CAS 2647420-09-3)
- 3-azatricyclo[7.3.1.0^{5,13}]trideca-1(12),5(13),6,8,10-pentaen-2-one (CAS 18833-41-5)
Recommended Standards
- Ethyl 20-(tosyloxy)-3,6,9,12,15,18-hexaoxaicosanoate (CAS 1254951-77-3)
- (2S,3R,4S,5R,6R)-6-((benzyloxy)methyl)-2-(ethylthio)-5-hydroxytetrahydro-2H-pyran-3,4-diyl dibenzoate (CAS 149521-64-2)
- Mupirocin EP Impurity D Sodium Salt (CAS 116182-43-5)
- Atorvastatin Impurity 95 (CAS 442851-50-5)
- 2-Chloro-7-cyclopentyl-N,N-dimethyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide (CAS 1211443-61-6)
- 1-(Phenylthio)propan-2-amine hydrochloride (CAS 56216-00-3)
- 3-(1,3-Thiazol-2-yl)phenylboronic acid (CAS 1316856-96-8)
- (4-(1H-benzo[d]imidazol-2-yl)cyclohexyl)methanamine hydrochloride (CAS 1431966-26-5)
- pregabalin Impurity 69 (CAS 1786719-42-3)
- cis-3-(methoxymethyl)cyclobutan-1-amine hydrochloride (CAS 1068160-25-7)
- 1-(Benzo[d]thiazol-2-yl)prop-2-en-1-one (CAS 192648-59-2)
- 41996-97-8 1-(4-Bromo-butyl)-4-vinylbenzene DTXSID10455865 (CAS 41996-97-8)
- 6-Bromo-3-methylbenzo[d]isoxazol-4-ol (CAS 1423702-25-3)
- Protein Kinase C (19-36) Peptide (CAS 113731-96-7)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
- Worldwide shipping with full export documentation (HS code guidance available)
- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com