Introduction：Basic information about CAS 38989-38-7|coralyne chloride hydrate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | coralyne chloride hydrate |
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| CAS Number | 38989-38-7 | Molecular Weight | 399.86700 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C22H22ClNO4 | Melting Point | 215ºC |
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| MSDS | / | Flash Point | / |
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Names
| Name | coralyne chloride hydrate, 98+% |
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| Synonym | More Synonyms |
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coralyne chloride hydrate BiologicalActivity
| Description | Coralyne chloride is a protoberberine alkaloid with potent anti-cancer activities. Coralyne chloride acts as a potent topoisomerase I poison and induces Top I mediated DNA cleavage[2]. Coralyne chloride can be used for preparing coralyne derivatives as DNA binding fluorescent probes[3]. |
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| Related Catalog | Research Areas >>CancerSignaling Pathways >>Cell Cycle/DNA Damage >>Topoisomerase |
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| Target | Topoisomerase I |
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| In Vitro | Coralyne (6.25-100 μM; 24-72 hours) has cytotoxicity effect on breast cancer cell lines. It against MCF-7, MDA-MB-231 and MCF-10A cells with IC50s of 76.4 uM, 76.4 uM, and 99 uM,respectively at 24 hours. And it against MCF-7, MDA-MB-231 and MCF-10A cells with IC50s of 21.9 uM, 19.1 uM, and 91 μM, respectively at 72 hours[1]. Coralyne (25 μM; 48 hours) significantly downregulates cancer cell attachment of MCF-7 and MDA-MB-231 compared to the untreated controls. The percent of reduction in adhesion of MCF-7 is 55%, whereas 53% in reduction in the adhesion of MDA-MB-23 and 62% in reduction of MCF-10A,respectively[1]. |
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| References | [1]. Seema Kumari, et al. Synergistic effects of coralyne and paclitaxel on cell migration and proliferation of breast cancer cells lines. Biomed Pharmacother. 2017 Jul;91:436-445. [2]. D Makhey, et al. Coralyne and related compounds as mammalian topoisomerase I and topoisomerase II poisons. Bioorg Med Chem. 1996 Jun;4(6):781-91. [3]. P M Pithan, et al. 8-Styryl-substituted coralyne derivatives as DNA binding fluorescent probes.RSC Adv. 2017 Feb 8;7(18):10660-10667. |
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Chemical & Physical Properties
| Melting Point | 215ºC |
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| Molecular Formula | C22H22ClNO4 |
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| Molecular Weight | 399.86700 |
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| Exact Mass | 399.12400 |
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| PSA | 41.02000 |
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| LogP | 1.07850 |
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| InChIKey | FJIKEFFDENQLIH-UHFFFAOYSA-M |
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| SMILES | COc1cc2cc3c4cc(OC)c(OC)cc4cc[n+]3c(C)c2cc1OC.O.[Cl-] |
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| Storage condition | 2-8°C |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- HQ1812000
- CHEMICAL NAME :
- Dibenzo(a,g)quinolizinium, 8-methyl-2,3,10,11-tetramethoxy-, chloride
- CAS REGISTRY NUMBER :
- 38989-38-7
- LAST UPDATED :
- 198605
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C22-H22-N-O4.Cl
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1240 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. (Bethesda, MD 20205) Volume(issue)/page/year: JAN1986
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Safety Information
| Hazard Codes | Xi: Irritant; |
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| Risk Phrases | R25 |
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| Safety Phrases | S45 |
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| RTECS | HQ1812000 |
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| HS Code | 2933990090 |
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Customs
| HS Code | 2933990090 |
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| 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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Synonyms
| 8-methyl-2,3,10,11-tetramethoxydibenzo(a,g)quinoliziniumchloride |
| EINECS 254-239-2 |
| coralyne chloride crystalline |
| g)quinolizinium,8-methyl-2,3,10,11-tetramethoxy-dibenzo(chloride |
| 2,3,10,11-tetramethoxy-8-methyldibenzo[a,g]quinolizinium chloride |
