1-(12-Methyl-5,7,17,19-tetraoxa-12-azahexacyclo[11.11.0.02,10.04,8.014,22.016,20]tetracosa-1(13),2,4(8),9,14,16(20),21,23-octaen-11-yl)-3-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)propan-2-one

分子结构分类

有机化合物 - 生物碱及其衍生物 - 苯并菲啶生物碱

中文名称

——

中文别名

——

英文名称

1-(12-Methyl-5,7,17,19-tetraoxa-12-azahexacyclo[11.11.0.02,10.04,8.014,22.016,20]tetracosa-1(13),2,4(8),9,14,16(20),21,23-octaen-11-yl)-3-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)propan-2-one

英文别名

1-(12-methyl-5,7,17,19-tetraoxa-12-azahexacyclo[11.11.0.02,10.04,8.014,22.016,20]tetracosa-1(13),2,4(8),9,14,16(20),21,23-octaen-11-yl)-3-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)propan-2-one

CAS

——

化学式

C₄₃H₃₂N₂O₉

mdl

——

分子量

720.7

InChiKey

QCSGZGGDMVZRNW-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

7.7
重原子数：

54
可旋转键数：

4
环数：

12.0
sp3杂化的碳原子比例：

0.23
拓扑面积：

97.4
氢给体数：

0
氢受体数：

11

同类化合物

血根黄碱血根碱血根碱血根樹鹼硝酸鹽紫堇灵紫堇洛星碱白屈菜默碱白屈菜赤碱白屈菜红碱氯化物白屈菜红碱白屈菜红碱白屈菜碱白屈菜宾甲酰胺,N-[6-(6-甲氧基-1,3-苯并二噁唑-4-基)萘并[2,3-d]-1,3-二噁唑-5-基]-N-甲基- 氯化血根碱水合物博落回醇碱博落回提取物二氢白屈菜红碱乙酰紫堇灵乙氧基血根碱丙酮基白屈菜赤碱 β-高白屈菜碱 N-[7-(6-羟基-1,3-苯并二氧戊环-5-基)苯并[f][1,3]苯并二氧戊环-8-基]-N-甲基甲酰胺 N-[6-(2-羟基-3,4-二甲氧基苯基)萘并[2,3-d][1,3]二氧杂环戊烯-5-基]-N-甲基甲酰胺 6-丙酮基二氢血根碱 4,9,10-三甲氧基-5b,12-二甲基-5b,6,7,11b,12,13-六氢苯并[c][1,3]二噁唑并[4,5-i]5-氮杂菲-6-醇 13,14-二氢血根碱 (5bR,6S,12bS,5b'R,6'S,12b'S,5b''R,6''S,12b''S)-13,13',13''-[硫代磷酰三(亚氨基乙烷-2,1-二基)]三(6-羟基-13-甲基-5b,6,7,12b,13,14-六氢[1,3]苯并二噁唑并[5,6-c][1,3]二噁唑并[4,5-i]5-氮杂菲-13-正离子)三氢氧化 (-)-白屈菜碱 (+)-白屈菜碱盐酸盐 chelilutine ψ-cyanide sanguinarine iodide 1-Ethoxy-12-ethyl-2-methoxy-12,13-dihydro-[1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine-13-carbonitrile N,O-diethyl-5,6-dihydroisodecarine 7-methoxy-5-methyl-2,3;9,10-bis(methylenedioxy)-5,6-dihydrobenzophenanthridine N,O-diethyl-5,6-dihydrodecarine O-ethyl-N-methylisodecarinium chloride 2-[18-[[3,5-Bis[4,5-bis(2-ethylhexyl)anthracen-9-yl]-4-methoxyphenyl]methyl]-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaen-7-yl]ethanol 2-Ethoxy-12-ethyl-1-methoxy-12,13-dihydro-[1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine-13-carbonitrile O-benzyl-N-methyl-5,6-dihydrodecarine trans-N-methyl-2,3-(methylenedioxy)-7,8-(methylenedioxy)-10b-methyl-4b,5,6,10b-tetrahydrobenzophenanthridine (5bS)-5b,13-dimethyl-(5br,12bt)-5b,12b,13,14-tetrahydro-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine 13-methyl-13-oxy-5b,6,7,12b,13,14-hexahydro-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-6-ol O-ethyl-N-methyldecarinium chloride (5bS)-5b,13-dimethyl-(5br,12bt)-5b,12b,13,14-tetrahydro-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine O-ethyl-N-methyl-5,6-dihydroisodecarine 8-ethoxy-5-ethyl-7-methoxy-2,3-methylenedioxybenzophenanthridin-6(5H)-one 1-Ethoxy-2-methoxy-12-methyl-12,13-dihydro-[1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine-13-carbonitrile Et-decarinium ethoxybocconine

1-(12-Methyl-5,7,17,19-tetraoxa-12-azahexacyclo[11.11.0.02,10.04,8.014,22.016,20]tetracosa-1(13),2,4(8),9,14,16(20),21,23-octaen-11-yl)-3-(24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-yl)propan-2-one

分子结构分类

计算性质

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