盐酸诺格考平 | 92621-03-9

分子结构分类

有机化合物 - 生物碱及其衍生物 - 邻苯二甲酸异喹啉类

中文名称

盐酸诺格考平

中文别名

——

英文名称

N-nornoscapine

英文别名

nornarcotine；1,3-dihydro-6,7-dimethoxy-3-[1,2,3,4-tetrahydro-8-methoxy-6,7-(methylenedioxy)isoquinolin-1-yl]isobenzofuran-1-one；(S)-6,7-dimethoxy-3-((R)-4-methoxy-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl) isobenzofuran-1(3H)-one；Norgnoscopine；(3S)-6,7-dimethoxy-3-[(5R)-4-methoxy-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-2-benzofuran-1-one

CAS

92621-03-9

化学式

C₂₁H₂₁NO₇

mdl

——

分子量

399.4

InChiKey

ZPSPOYAHTOQXBP-SJORKVTESA-N

BEILSTEIN

——

EINECS

——

物化性质

沸点：

583.8±50.0 °C(Predicted)
密度：

1.352±0.06 g/cm3(Predicted)

计算性质

辛醇/水分配系数(LogP)：

2.2
重原子数：

29
可旋转键数：

4
环数：

5.0
sp3杂化的碳原子比例：

0.38
拓扑面积：

84.5
氢给体数：

1
氢受体数：

8

上下游信息

上游原料

中文名称	英文名称	CAS号	化学式	分子量
那可汀	noscapine	6035-40-1	C₂₂H₂₃NO₇	413.427
——	narcotine N-oxide	54383-36-7	C₂₂H₂₃NO₈	429.427

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	(S)-3-((R)-9-bromo-4-methoxy-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-6,7-dimethoxyisobenzofuran-1(3H)-one	——	C₂₁H₂₀BrNO₇	478.296
——	(5R)-5-((1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl)-4-methoxy-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline	488720-99-6	C₂₁H₂₃NO₆	385.417
——	N-desmethyl-N-carbethoxynarcotine	——	C₂₄H₂₅NO₉	471.464
——	(R)-5-((S)-4,5-dimethoxy-1,3-dihydroisobenzofuran-1-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]-dioxolo[4,5-g]isoquinoline	87633-29-2	C₂₂H₂₅NO₆	399.444
——	1-[(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-yl]ethanone	1422532-54-4	C₂₃H₂₅NO₇	427.454
——	1-[(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-yl]-2-phenylethanone	1422532-57-7	C₂₉H₂₉NO₇	503.552
——	1-[(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-yl]propan-1-one	1422532-55-5	C₂₄H₂₇NO₇	441.481
——	(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-N-ethyl-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carbothioamide	1422532-69-1	C₂₄H₂₈N₂O₆S	472.562
——	(5R)-N-benzyl-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carbothioamide	1422532-72-6	C₂₉H₃₀N₂O₆S	534.633
——	(5~{R})-5-[(1~{S})-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-~{N}-ethyl-4-methoxy-7,8-dihydro-5~{H}-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-60-2	C₂₄H₂₈N₂O₇	456.496
——	(5R)-N-benzyl-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-65-7	C₂₉H₃₀N₂O₇	518.566
——	(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-N-propyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carbothioamide	1422532-70-4	C₂₅H₃₀N₂O₆S	486.589
——	(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-N-propyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-61-3	C₂₅H₃₀N₂O₇	470.522
——	benzyl (5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxylate	1422532-59-9	C₂₉H₂₉NO₈	519.551
——	(5R)-N-butyl-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-62-4	C₂₆H₃₂N₂O₇	484.549
——	(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-N-pentyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-63-5	C₂₇H₃₄N₂O₇	498.576
——	(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-N-phenyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-64-6	C₂₈H₂₈N₂O₇	504.54
——	(5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-N-phenyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carbothioamide	1422532-71-5	C₂₈H₂₈N₂O₆S	520.606
——	phenyl (5R)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxylate	1422532-58-8	C₂₈H₂₇NO₈	505.524
——	(5R)-N-(4-chlorophenyl)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-67-9	C₂₈H₂₇ClN₂O₇	538.985
——	(5R)-N-(4-chlorophenyl)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carbothioamide	1422532-75-9	C₂₈H₂₇ClN₂O₆S	555.051
——	N-(3-chlorophenyl)-1-(1,3-dihydro-4,5-dimethoxyisobenzofuran-1-yl)-1,2,3,4-tetrahydro-8-methoxy-6,7-(methylenedioxy)isoquinoline-2-carboxamide	——	C₂₈H₂₇ClN₂O₇	538.985
——	(5R)-N-(3-chlorophenyl)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carbothioamide	1422532-74-8	C₂₈H₂₇ClN₂O₆S	555.051
——	(5R)-N-(2-chlorophenyl)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-66-8	C₂₈H₂₇ClN₂O₇	538.985
——	(5R)-N-(2-chlorophenyl)-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carbothioamide	1422532-73-7	C₂₈H₂₇ClN₂O₆S	555.051
——	(5R)-N-[3,5-bis(trifluoromethyl)phenyl]-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carboxamide	1422532-68-0	C₃₀H₂₆F₆N₂O₇	640.536
——	(5R)-N-[3,5-bis(trifluoromethyl)phenyl]-5-[(1S)-4,5-dimethoxy-1,3-dihydro-2-benzofuran-1-yl]-4-methoxy-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline-6-carbothioamide	1422532-76-0	C₃₀H₂₆F₆N₂O₆S	656.603

反应信息

作为反应物：

描述：

盐酸诺格考平在 ferrous(II) sulfate heptahydrate 、 sodium tetrahydroborate 、三氟化硼乙醚、水、间氯过氧苯甲酸、 sodium hydroxide 作用下，以