(4S,4Ar,13Bs,14As)-Methyl 4-Methyl-4A,5,7,8,13,13B,14,14A-Octahydro-4H-Indolo[2,3-A]Pyrano[3,4-G]Quinolizine-1-Carboxylate (4S,4aR,13bS,14aS)-4-甲基-4a,5,7,8,13,13b,14,14a-八氢-4H-吲哚并[2,3-a]吡喃并[3,4-g]喹嗪-1-羧酸甲酯
CAS 483-04-5 MFCD00483045
化学结构图
SMILES: COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
化学属性
| Mol. Weight | 352.43 |
|---|---|
| Mol. Formula | C21 H24 N2 O3 |
| Melting Point | ~258 °C (dec.) |
| Boiling Point | - |
| Flash Point | - |
别名和识别编码
| Synonym | δ-Yohimbine,Py-Tetrahydroserpentine,Raubasine δ-育亨宾碱 四氢蛇根碱 萝巴新 16,17-Didehydro-19-methyloxayohimban-16-carboxylic acid methyl ester Ajmalicin Alkaloid C Alkaloid F Alkaloid II Hydrosarpan Lamuran Oxayohimban-16-carboxylic acid, 16,17-didehydro-19-methyl-, methyl ester, Raubasine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { |
|---|---|
| Chemical Name | (4S,4Ar,13Bs,14As)-Methyl 4-Methyl-4A,5,7,8,13,13B,14,14A-Octahydro-4H-Indolo[2,3-A]Pyrano[3,4-G]Quinolizine-1-Carboxylate |
| Chemical Name Translation | (4S,4aR,13bS,14aS)-4-甲基-4a,5,7,8,13,13b,14,14a-八氢-4H-吲哚并[2,3-a]吡喃并[3,4-g]喹嗪-1-羧酸甲酯 |
| Beilstein Registry Number | 0097268 |
| EC Number | 207-589-5 |
| CAS Number | 483-04-5 |
| InChIKey | GRTOGORTSDXSFK-XJTZBENFSA-N |
| Wiswesser Line Notation | T F6 D5 C666 EM ON SO TU&&TTTJ R1 UVO1 |
| LabNetwork Molecule ID | LN01310917 |
| Canonical SMILES | COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 |
| MDL Number | - |
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分类
- {SNA} Terpenoids, 代谢组学, 代谢通路, 细胞生物学, 萜类代谢
- {SNA} Metabolic Pathways, Terpenoid Metabolism, Terpenoids, 代谢组学, 细胞生物学
相关文献及参考
- [2]. Roquebert J, et al. Inhibition of the alpha 1 and alpha 2-adrenoceptor-mediated pressor response in pithed rats by raubasine, tetrahydroalstonine and akuammigine. Eur J Pharmacol. 1984 Oct 30;106(1):203-5.
- [3]. Pereira DM, et al. Pharmacological effects of Catharanthus roseus root alkaloids in acetylcholinesterase inhibition and cholinergic neurotransmission. Phytomedicine. 2010 Jul;17(8-9):646-52.
- [4]. • Demichel P, et al. Effects of raubasine stereoisomers on pre- and postsynaptic alpha-adrenoceptors in the rat vas deferens. Br J Pharmacol. 1984 Oct;83(2):505-10
- [1]. Wink, Michael; Roberts, M. W. (1998). Alkaloids: biochemistry, ecology, and medicinal applications. New York: Plenum Press. ISBN 0-306-45465-3.
- [1]. Wink, Michael; Roberts, M. W. (1998). Alkaloids: biochemistry, ecology, and medicinal applications. New York: Plenum Press. ISBN 0-306-45465-3.
- [2]. Roquebert J, et al. Inhibition of the alpha 1 and alpha 2-adrenoc
安全信息
GHS Symbol
- H302 Harmful if swallowed 吞食有害
- R22 Harmful if swallowed 吞咽有害
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 200 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,117,1972
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 165 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,117,1972
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 20 mg/kg TOXIC EFFECTS :
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 24 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,117,1972
TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - guinea pig DOSE/DURATION : 20 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951-
其他信息
- Ajmalicine (d-Yohimbine, Py-Tetrahydroserpentine, Raubasine) is an alkaloid used to study its effects as an antagonist of adrenergic and nicotinic receptors.
