Introduction：Basic information about CAS 316-41-6|AI3-61947, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | AI3-61947 |
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| CAS Number | 316-41-6 | Molecular Weight | 768.78500 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C40H36N2O12S | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | berberine sulfate trihydrate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Molecular Formula | C40H36N2O12S |
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| Molecular Weight | 768.78500 |
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| Exact Mass | 768.19900 |
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| PSA | 170.24000 |
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| LogP | 5.93540 |
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| InChIKey | OJVABJMSSDUECT-UHFFFAOYSA-L |
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| SMILES | COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2.COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2.O=S(=O)([O-])[O-] |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DR9867300
- CAS REGISTRY NUMBER :
- 316-41-6
- LAST UPDATED :
- 198307
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C40-H36-N2-O8.O4-S
- MOLECULAR WEIGHT :
- 768.84
- WISWESSER LINE NOTATION :
- T F5 D6 C666 GO IO OK HH&&T&&J RO1 SO1 2 &..S-O4
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 26400 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,770,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 13200 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,770,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 8200 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,770,1982
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Safety Information
| RIDADR | UN 1544 |
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| RTECS | DR9867300 |
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| Packaging Group | III |
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| Hazard Class | 6.1(b) |
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Synonyms
| berberinsu |
| berberinesulfate(2:1) |
| fate(2:1) |
| berberinsulfate |
| EINECS 206-258-2 |
| BERBERINE SULFATE HYDRATE |
| neutralberberinesulfate |
| berberine sulphate |
| ulfate(2:1) |
| BERBERINE SULFATE N-HYDRATE |
| BERBERINE SULFATE |
