CAS Number85547-22-4
Synonyms8,9-dimethoxy-4h-benzo[de][1,6]naphthyridine; 8,9-Dimethoxy-1H-benzo(de)(1,6)naphthyridine; Aaaptamine Hydrochloride; 1H-Benzo(de)(1,6)naphthyridine,8,9-dimethoxy
Molecular FormulaC13H12N2O2
Molecular Weight228.24700
Purity98%%
Density1.246g/cm3
Boiling Point420.578ºC at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 85547-22-4 |
| Catalog No. | 2A-1200160 |
| Chinese Name | 阿普他明 |
| Synonyms | 8,9-dimethoxy-4h-benzo[de][1,6]naphthyridine; 8,9-Dimethoxy-1H-benzo(de)(1,6)naphthyridine; Aaaptamine Hydrochloride; 1H-Benzo(de)(1,6)naphthyridine,8,9-dimethoxy |
| Molecular Formula | C13H12N2O2 |
| Molecular Weight | 228.24700 |
| Purity | 98% |
| Density | 1.246g/cm3 |
| Boiling Point | 420.578ºC at 760 mmHg |
| Storage Condition | Sealed in a cool, dry environment |
| Application | Aaptamine is an alkaloid isolated from the marine sponge Aaptos aaptos. It is a competitive antagonist of α-adrenergic receptors and activates the p21 promoter independently of the p53 pathway. |
| HTC | 2933990090 |
| SMILES | COc1cc2c3c(ccnc3c1OC)NC=C2 |
| InChI | InChI=1S/C13H12N2O2/c1-16-10-7-8-3-5-14-9-4-6-15-12(11(8)9)13(10)17-2/h3-7,14H,1-2H3 |
| InChI Key | UERYGOYPBXIFQV-UHFFFAOYSA-N |
| Use of | Aaptamine, a spongean alkaloid isolated from a sea sponge Aaptos aaptos, is a competitive antagonist of α-adrenoceptor and activates the p21 promoter in a p53-independent manner[1][1]. Properties Name Aaptamine Synonym More Synonyms Aaptamine Biological Activity Description Aaptamine, a spongean alkaloid isolated from a sea sponge Aaptos aaptos, is a competitive antagonist of α-adrenoceptor and activates the p21 promoter in a p53-independent manner[1][1]. Related Catalog Research Areas >> Cancer Signaling Pathways >> GPCR/G Protein >> Adrenergic Receptor References [1]. Ohizumi Y, et al. Alpha-adrenoceptor blocking action of aaptamine, a novel marine natural product, in vascular smooth muscle. J Pharm Pharmacol. 1984 Nov;36(11):785-6. [2]. Aoki S, et al. Aaptamine, a spongean alkaloid, activates p21 promoter in a p53-independent manner. Biochem Biophys Res Commun. 2006 Mar 31;342(1):101-6. Chemical & Physical Properties Molecular Formula C13H12N2O2 Exact Mass 228.09000 PSA 47.14000 LogP 2.73330 Index of Refraction 1.641 InChIKey UERYGOYPBXIFQV-UHFFFAOYSA-N Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : 1H-Benzo(de)(1,6)naphthyridine, 8,9-dimethoxy- CAS REGISTRY NUMBER : 85547-22-4 LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C13-H12-N2-O2 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Mammal - species unspecified DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : KHFZAN Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1967- Volume(issue)/page/year: 24(7),15,1990 Safety Information HS Code 2933990090 Synthetic Route 6-Methoxy-3,4-d... 85547-22-4 Literature: Pelletier, Jeffrey C.; Cava, Michael P. Journal of Organic Chemistry, 1987 , vol. 52, # 4 p. 616 - 622 96838-32-3 85547-22-4 Literature: Pelletier, Jeffrey C.; Cava, Michael P. Journal of Organic Chemistry, 1987 , vol. 52, # 4 p. 616 - 622 96838-34-5 85547-22-4 Literature: Pelletier, Jeffrey C.; Cava, Michael P. Journal of Organic Chemistry, 1987 , vol. 52, # 4 p. 616 - 622 Precursor & DownStream Precursor 2 CAS#:4602-73-7 6-Methoxy-3,4-d... CAS#:3382-18-1 Dehydroheliamine DownStream 0 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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