CAS: 561-94-4; Ergosine

该化合物是一种来自菌菌菌的藻类, 具体来说, 是来自长效菌的菌种, 是一种叫作长效菌的藻类, 是被称为长效藻类的更大种类的化合物的一部分, 以其复杂的结构及多种生物活动而著称.Ergosine的特点是能够与各种...

英文名称Ergosine
中文名称麦角生碱
IUPAC名称(6aR,9R)-N-[(1S,2S,4R,7S)-2-hydroxy-4-methyl-7-(2-methylpropyl)-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
其它别名Ergosine(6CI,7CI,8CI); 8H-Oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine, ergotaman-3',6',18-trionederiv.; Indolo[4,3-fg]quinoline, ergotaman-3',6',18-trione deriv.; a-Ergosine
CAS编号561-94-4
MFCD编号:MFCD01729206
EINECS号:209-226-6
FDA UNII编号:6WF908487H
分子式:C30H37N5O5分子量:547.65
产品CID: 2508846
产品分类有机原料 → 生物碱及其衍生物 → 麦角林及其衍生物

相似结构搜索
InChIKey: NESVMZOPWPCFAU-ZPRCMDFASA-N
InChI=1S/C30H37N5O5/c1-16(2)11-23-27(37)34-10-6-9-24(34)30(39)35(23)28(38)29(3,40-30)32-26(36)18-12-20-19-7-5-8-21-25(19)17(14-31-21)13-22(20)33(4)15-18/h5,7-8,12,14,16,1
计算化学: 氢键受体数6.0氢键供体数3.0可旋转键数4.0

MSDS等安全信息

GHS象形图
GHS符号GHS06;
注释: Skull and crossbones
危险类别急性毒性类别3(经口)
警示词Danger(危险)
危险描述H301 |吞咽会中毒.
防范说明P264-P270-P301+P310-P321-P330-P405-P501
危险等级6.1(b)
UN编号1544
包装等级III

欧盟法规

ECHA物质C&L通报REACH预注册

合成工艺路线路线简述

📜Alkaline Earth Salt Of/the/ Methylsulfuric Acid置于乙醇,磷酸,丙酮体系中,化学反应生成麦角生碱
参考文献:83.麦角的生物碱.第八部分麦角的新生物碱:麦角碱和麦角碱
标题:83.麦角的生物碱.第八部分麦角的新生物碱:麦角碱和麦角碱
摘要:
DOI:10.1039/jr9370000396

海关参考信息

2901210000-乙烯
2901220000-丙烯
2902500000-苯乙烯
2902600000-乙苯
💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
详情请参考：📖 海关编码查询和海关进出口税则

专利信息

专利号:US-3968112-A
优先权日:1974-08-02
标题:Synthesis of penniclavine and elymoclavine
发明人：KORNFELD EDMUND C; BACH NICHOLAS J
权利人:LILLY CO ELI
摘要:Synthesis of penniclavine and of elymoclavine, intermediates useful therein, and novel compounds producible therefrom.

专利号:US-3923812-A
优先权日:1974-08-02
标题:Synthesis of elymoclavine
发明人：BACH NICHOLAS J; KORNFELD EDMUND C
权利人:LILLY CO ELI
摘要:Elymoclavine is prepared by oxidation of D-6-methyl-8hydroxymethyl-10 Alpha -methoxy-8-ergolene to the corresponding D-8-aldehyde followed by reduction with an active metal in acid medium.

专利号:US-4082753-A
优先权日:1976-02-17
标题:Penniclavine acetonide
发明人：KORNFELD EDMUND C; BACH NICHOLAS J
权利人:LILLY CO ELI
摘要:Synthesis of penniclavine and of elymoclavine, intermediates useful therein, and novel compounds producible therefrom.

专利号:US-4054567-A
优先权日:1975-08-11
标题:6-Methyl-8Î²-hydroxymethyl-8-Î³-substituted-9-ergolene compounds
发明人：KORNFELD EDMUND C; BACH NICHOLAS J
权利人:LILLY CO ELI
摘要:Synthesis of penniclavine and of elymoclavine, intermediates useful therein, and novel compounds producible therefrom.

专利号:US-3314959-A
优先权日:1961-05-10
标题:Intermediates for the synthesis of ergot alkaloids
发明人：ALBERT HOFMANN; ALBERT FREY; HANS OTT
权利人:SANDOZ LTD

专利号:PT-89427-B
优先权日:1988-01-13
标题 :PROCESS FOR ENHANCING ENZYME ACTIVITY AND SYNTHESIS OF ORGANISMS

其他信息查阅

供应商参考报价(招募中)

品牌试剂参考报价(招募中)

实用工具

📌 第三方产品分析报告

✅ COA系统入驻 | 共享模式

合成参考文献

摘要:Experientia., 33(1552), 1977 []
参考文献:10.1126/science.3008328
摘要:Lyons PC, Plattner RD, Bacon CW. Occurrence of peptide and clavine ergot alkaloids in tall fescue grass. Science. 1986 Apr 25;232(4749):487–9. doi: 10.1126/science.3008328.
参考文献:10.1002/rcm.2648
摘要:Mohamed R, Gremaud E, Tabet JC, Guy PA. Mass spectral characterization of ergot alkaloids by electrospray ionization, hydrogen/deuterium exchange, and multiple stage mass spectrometry: Usefulness of precursor ion scan experiments. Rapid Commun Mass Spectrom. 2006;20(19):2787–99. doi: 10.1002/rcm.2648.