131-02-2 (利舍匹林,Methyl (3beta,19alpha,20alpha)-16,17-didehydro-10,11-dimethoxy-19-methyloxayohimban-16-carboxylate)

快速询单

结构式：

利舍匹林MOL文件

CAS号：

131-02-2

中文名称：

利舍匹林

英文名称：

Methyl (3beta,19alpha,20alpha)-16,17-didehydro-10,11-dimethoxy-19-methyloxayohimban-16-carboxylate

分子式：

C₂₃H₂₈N₂O₅

分子量：

412.478826522827

利舍匹林(131-02-2)名称与标识符

名称

中文别名：

5-氯-1-(4-氟苯基)-1H-吡唑-3-羧酸乙酯;利舍匹林;利血皮林碱;

英文别名：

4H-Indolo[2,3-a]pyrano[3,4-g]quinolizine-1-carboxylicacid, 4a,5,7,8,13,13b,14,14a-octahydro-10,11-dimethoxy-4-methyl-, methyl ester,(4S,4aS,13bR,14aS)-;(-)-Reserpiline;4H-Indolo[2,3-a]pyrano[3,4-g]quinolizine-1-carboxylicacid, 4a,5,7,8,13,13b,14,14a-octahydro-10,11-dimethoxy-4-methyl-, methyl;4H-Indolo[2,3-a]pyrano[3,4-g]quinolizine-1-carboxylicacid, 4a,5,7,8,13,13b,14,14a-octahydro-10...;Elliptamine;methyl (3beta,19alpha,20alpha)-10,11-dimethoxy-19-methyl-16,17-didehydro-18-oxayohim;Methyl (3beta,19alpha,20alpha)-16,17-didehydro-10,11-dimethoxy-19-methyloxayohimban-16-carboxylate;Methyl 16,17-didehydro-10,11-dimethoxy-19alpha-methyl-18-oxa-3beta,20alpha-yohimban-16-carboxylat;Oxayohimban-16-carboxylic acid, 16,17-didehydro-10,11-dimethoxy-19-methyl-, methyl ester, (3-beta,19-alpha,20-alpha)-;Reserpilin;Reserpiline;Einecs 205-005-3;(3β,20α)-16,17-Didehydro-19α-methyl-10,11-dimethoxy-18-oxayohimban-16-carboxylic acid methyl ester;(3β,20α)-16,17-Didehydro-10,11-dimethoxy-19α-methyl-18-oxayohimban-16-carboxylic acid methyl ester;CHEBI:135667;methyl (1R,15S,16S,20S)-6,7-dimethoxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,18-pentaene-19-carboxylate;AKOS040753731;131-02-2;NS00041576;Oxayohimban-16-carboxylic acid, 16,17-didehydro-10,11-dimethoxy-19-methyl-, methyl ester, (3.beta.,19.alpha.,20.alpha.)-;methyl (4S,4aS,13bR,14aS)-10,11-dimethoxy-4-methyl-4a,5,7,8,13,13b,14,14a-octahydro-4H-indolo[2,3-a]pyrano[3,4-g]quinolizine-1-carboxylate;SCHEMBL355882;RESERPILINE [WHO-DD];UNII-C0N6EP99UK;RESERPILINE [MI];methyl 10,11-dimethoxy-19-methyl-16,17-didehydro-18-oxayohimban-16-carboxylate;4H-INDOLO(2,3-A)PYRANO(3,4-G)QUINOLIZINE-1-CARBOXYLIC ACID, 4A,5,7,8,13,13B,14,14A-OCTAHYDRO-10,11-DIMETHOXY-4-METHYL-, METHYL ESTER, (4S,4AS,13BR,14AS)-;DTXSID20927028;C0N6EP99UK;Q27275019;

标识符

InChIKey：

FGWJRZQNNZVCHR-BCRCDCHUSA-N

Inchi：

1S/C23H28N2O5/c1-12-16-10-25-6-5-13-15-8-20(27-2)21(28-3)9-18(15)24-22(13)19(25)7-14(16)17(11-30-12)23(26)29-4/h8-9,11-12,14,16,19,24H,5-7,10H2,1-4H3/t12-,14-,16-,19+/m0/s1

SMILES：

O1C=C(C(=O)OC)[C@H]2C[C@@H]3C4=C(C5C=C(C(=CC=5N4)OC)OC)CCN3C[C@H]2[C@@H]1C

利舍匹林(131-02-2)物化性质

实验特性

PSA : 73.02
沸点 : 569.9±50.0 °C at 760 mmHg
蒸气压 : 0.0±1.6 mmHg at 25°C
闪点 : 298.4±30.1 °C
颜色与性状 : No data avaiable
比旋光度 : D20 -38° (ethanol); -14° (c = 1.5 in pyridine); -12° (c = 1.7 in chloroform)
密度 : 1.3±0.1 g/cm3