Sodium Dehydrocholate 脱氢胆酸钠
CAS 145-41-5 MFCD00066411
化学结构图
SMILES: CC(CCC(=O)[O-])C1CCC2C3C(=O)CC4CC(=O)CCC4(C)C3CC(=O)C12C.[Na+]
化学属性
| Mol. Formula | C₂₄H₃₃NaO₅ |
|---|---|
| Mol. Weight | 424.51 |
| Melting Point | >236°C (dec.) |
| Boiling Point |
别名和识别编码
| Chemical Name | Sodium Dehydrocholate |
|---|---|
| MDL Number | MFCD00066411 |
| CAS Number | 145-41-5 |
| EC Number | 205-652-1 |
| Synonym | 3,7,12-Trioxo-5beta-cholanic acid sodium salt 3,7,12-三氧-5β-胆烷酸 钠盐 去氢胆酸 钠盐 5-beta-Cholan-24-oic acid, 3,7,12-trioxo-, monosodium salt Biliron Biliton Carachol Cholan-24-oic acid, 3,7,12-trioxo-, sodium salt, (5-beta)- Decholin sodium Decholin sodium salt Dehydrocholate sodium Dehydrocholic acid, sodium salt Dilabil sodium Dycholium Natriumdehydrocholat Sodium 3,7,12-triketocholanate Sodium 3,7,12-trioxo-5-beta-cholan-24-oate Sodium 3,7,12-trioxo-5-beta-cholanate Sodium Dehydrocholate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { |
| Beilstein Registry Number | 4119624 |
| Reaxys-RN | 4902837 |
| PubChem Substance ID | 23675007 |
| Merck Number | 2868 |
| Chemical Name Translation | 脱氢胆酸钠 |
| LabNetwork Molecule ID | LN01741292 |
| InChI | InChI=1S/C24H34O5.Na/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26;/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29);/q;+1/p-1/t13-,14+,16-,17+,18+,22+,23+,24-;/m1./s1 |
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安全信息
- H303 May be harmfully swallowed 吞食可能有害
- P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 3755 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : GWXXBX German Offenlegungsschrift Patent Document. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #2630169
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 1480 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : RPOBAR Research Progress in Organic-Biological and Medicinal Chemistry. (New York, NY) V.1-3, 1964-72. Discontinued. Volume(issue)/page/year: 2,280,1970
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 1350 mg/kg TOXIC EFFECTS : Behavioral - convulsions or effect on seizure threshold Behavioral - excitement REFERENCE : YOIZA3 Yonago Igaku Zasshi. Journal of the Yonago Medical Association. (c/o Tottori Daigaku Igakabu, 86 Nishi-machi, Yonago, Japa
TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - rabbit DOSE/DURATION : 1 gm/kg TOXIC EFFECTS : Cardiac - other changes Gastrointestinal - other changes Blood - other changes REFERENCE : ZGEMAZ Zeitschrift fuer die Gesamte Experimentelle Medizin. (Berlin, Fed. Rep. Ger.) V.1-139, 1913-65. For publisher information, see REXMAS. Volume(issue)/page/year: 52,779,1926
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenou
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