CAS: 483-09-0; Methyl (1S,2S,4As,13Br,14As)-2-Hydroxy-1,2,3,4,4A,5,7,8,13,13B,14,14A-Dodecahydroindolo[2',3':3,4]Pyrido[1,2-B]Isoquinoline-1-Carboxylate

该化合物是一种化学化合物,产自蛋白碱,是一种无胆碱碱碱,其特点是结构复杂,由含有多个立体分点的叶黑骨组成,有助于其特定的三维配置.它通常看起来像白色的脱白晶线固体,在有机溶剂中可溶解,但水溶性有限.复合生物活动,特别是它可能对...

英文名称Methyl (1S,2S,4As,13Br,14As)-2-Hydroxy-1,2,3,4,4A,5,7,8,13,13B,14,14A-Dodecahydroindolo[2',3':3,4]Pyrido[1,2-B]Isoquinoline-1-Carboxylate
中文名称异柯楠碱
IUPAC名称methyl (1S,2S,4aS,13bR,14aS)-2-hydroxy-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydroindolo[2',3':3,4]pyrido[1,2-b]isoquinoline-1-carboxylate
其它别名(3β,20α)-17α-Hydroxyyohimban-16β-Carboxylic Acid Methyl Ester; 3-Epi-α-Yohimbine; Isorauhimbine; Epi-3Alpha-Yohimbine; 3-Epiisoyohimbine; Methyl(1R,15S,18S,19S,20S)-18-Hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-Dodecahydroyohimban-19-Carboxylate; Yohimban-16-Carboxylic Acid, 17-Hydroxy-, Methyl Ester, (3β,16β,17α,20α)-
CAS编号483-09-0
MFCD编号:MFCD20260530
分子式:C21H26N2O3分子量:354.45
产品CID: 1477206
产品分类天然产物 → 生物碱

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产品信息参考;;
InChIKey: BLGXFZZNTVWLAY-RIEHRDFOSA-N
InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15+,17-,18+,19+/m1/s1
计算化学: 氢键受体数4.0氢键供体数2.0可旋转键数2.0

MSDS等安全信息

上下游产品

methyl (16α)-17-oxoyohimban-16-carboxylate (20β)-18,19-didehydroyohimban-17-one dimethyl (16α)-17-oxoyohimban-1,16-dicarboxylate 3-(3-Ethylindol-2-yl)-5,6,7,8-tetrahydroisoquinoline rauwolscine Yohimbine

合成工艺路线路线简述

📜17α-Hydroxy-16β-Methoxycarbonyl-20α-Yohimb-3-Enium; Perchlorate置于盐酸,锌体系中,化学反应生成异柯楠碱
参考文献:The Reaction Of Rauwolfia Alkaloids With Mercuric Acetate. Conversion Of 3-Isoreserpine To Reserpine
标题:The Reaction Of Rauwolfia Alkaloids With Mercuric Acetate. Conversion Of 3-Isoreserpine To Reserpine
摘要:
DOI:10.1021/ja01590A078

海关参考信息

2902200000-苯
2905122000-异丙醇
2905399001-1,3-丙二醇
2912110000-甲醛
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合成参考文献

参考文献:10.1021/np0200919
摘要:Sheludko Y, Gerasimenko I, Kolshorn H, Stöckigt J. New alkaloids of the sarpagine group from Rauvolfia serpentina hairy root culture. J Nat Prod. 2002 Jul;65(7):1006–10. doi: 10.1021/np0200919.