18-(cyclopentyloxy)-19-hydroxy-9-({1-hydroxy-6,7-dihydro-5H-benzo[7]annulen-7-yl}methyl)-12-(2-hydroxyethyl)-11,13-dioxo-5,31,33-triazaheptacyclo[25.6.2.1¹⁶,²⁰.1²²,²⁶.0²,¹⁰.0⁴,⁸.0²⁸,³²]heptatriaconta-2,4(8),5,16(37),17,19,22(36),23,25,29,31-undecaene-7,28-diide

分子结构分类

有机化合物 - 有机杂环化合物 - Pyrroloazepines

中文名称

——

中文别名

——

英文名称

18-(cyclopentyloxy)-19-hydroxy-9-({1-hydroxy-6,7-dihydro-5H-benzo[7]annulen-7-yl}methyl)-12-(2-hydroxyethyl)-11,13-dioxo-5,31,33-triazaheptacyclo[25.6.2.1¹⁶,²⁰.1²²,²⁶.0²,¹⁰.0⁴,⁸.0²⁸,³²]heptatriaconta-2,4(8),5,16(37),17,19,22(36),23,25,29,31-undecaene-7,28-diide

英文别名

——

18-(cyclopentyloxy)-19-hydroxy-9-({1-hydroxy-6,7-dihydro-5H-benzo[7]annulen-7-yl}methyl)-12-(2-hydroxyethyl)-11,13-dioxo-5,31,33-triazaheptacyclo[25.6.2.1¹⁶,²⁰.1²²,²⁶.0²,¹⁰.0⁴,⁸.0²⁸,³²]heptatriaconta-2,4(8),5,16(37),17,19,22(36),23,25,29,31-undecaene-7,28-diide化学式

CAS

——

化学式

C53H55N3O6-2

mdl

——

分子量

——

InChiKey

JXGZPMZIVFFKHB-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

9.49
重原子数：

62.0
可旋转键数：

6.0
环数：

10.0
sp3杂化的碳原子比例：

0.4
拓扑面积：

141.87
氢给体数：

4.0
氢受体数：

9.0

同类化合物

顺式-2-BOC-八氢-吡咯并[3,4-D]氮杂庚烷羟甲磺酸二甲磺酸环戊二烯并[4,5]氮杂卓并[2,1,7-cd]吡咯里嗪四氢-1H-吡咯并[1,2-a]氮杂卓-3,9(2H,9aH)-二酮吡咯并[1,2-a]氮杂-5-酮吖庚英并[4,3-b]吲哚-1(2H)-酮,7-氟-3,4,5,6-四氢-6-甲基- 六氢-1H-吡咯并[1,2-A]氮杂卓-5(6H)-酮 N,N-二甲基-3-(3-甲基-1,2,4,5-四氢氮杂卓并[4,5-b]吲哚-6-基)丙-1-胺 9-氟-3,4-二氢-1H-吡啶并[4,3-B]吲哚-2(5H)-羧酸叔丁酯 9-氟-1,2,3,4,5,6-六氢氮杂卓并[4,5-b]吲哚 7,8-二氢-5H-吡咯并[1,2-A]氮杂环庚烷-9(6H)-酮 6-叔-丁基3A-乙基八氢吡咯并[2,3-D]氮杂卓-3A,6(2H)-二甲酸基酯 6,7-二氢吡咯并[2,3-c]氮杂卓-4,8(1H,5H)-二酮 5H-吡咯并[1,2-a]氮杂卓-7-醇 5,9:7,11-二亚甲基-5H-吡咯并[1,2-a]吖壬英-3-羧酸,6,7,8,9,10,11-六氢-,甲基酯 4-(2-氨基-1H-咪唑-5-基)-2,3-二溴-6,7-二氢吡咯并[2,3-c]氮杂卓-8(1H)-酮 4-(2-氨基-1H-咪唑-4-基)-2,3-二溴-4,5,6,7-四氢吡咯并[2,3-c]氮杂卓-8(1H)-酮 4-(2-氨基-1,5-二氢-5-氧代-4H-咪唑-4-亚基)-4,5,6,7-四氢-吡咯并[2,3-c]氮杂卓-8(1H)-酮 3-苄基-1,2,3,4,5,6-六氢氮杂卓并[4,5-b]吲哚 3-(3,9-二甲基-1,2,4,5-四氢氮杂卓并[4,5-b]吲哚-6-基)-N,N-二甲基丙烷-1-胺 2H,3H-氧杂环丁烷并[3,2-d]吡咯并[1,2-a]氮杂卓 2-碘-1,5,6,7-四氢-4H-吡咯并[3,2-C]吡啶-4-酮 2-溴-6,7-二氢-1h,5h-吡咯并[2,3-c]氮杂烷-4,8-二酮 2-溴-5,6,7,8-四氢吡咯并[3,2-C]氮杂庚烷-4(1H)-酮 2,5-已炔二醇 2,3,4,5-四氢-N,N-二甲基-2-(3,4,5-三甲氧基苯甲酰基)-氮杂卓并(3,4-b)吲哚-10(1H)-丙胺 11-氧杂-3,10-二氮杂三环[7.2.1.03,7]十二碳-1,4,6,9-四烯 1-苄基-八氢-吡咯并[3,4-b]吡啶 1,4,5,6,7,8-六氢吡咯并[3,2-b]氮杂卓 1,2,3,4,5,6-六氢氮杂环庚烷[4,3-B]吲哚盐酸盐 1,2,3,4,5,6-六氢-9-甲基氮杂卓并[4,5-b]吲哚 1,2,3,4,5,6-六氢-6-甲基氮杂革[4,5-b]吲哚盐酸盐 1,2,3,4,5,6-六氢-3-甲基氮杂卓并[4,5-b]吲哚 4-acetoxy-5,18-seco-20,21-dinor-ibogamine 3-(4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-(1-(4-ethyl-3,5-dimethyl-1H-pyrrol-2-yl)ethylidene)-1H-isoindole (7S,10R)-2-methyl-5-[(Z)-2-(6-methylpyridin-3-yl)vinyl]-5,6,7,8,9,10-hexahydro-7,10-epiminocyclohepta[b]indole 6-[(6-chloropyridin-3-yl)methyl]-9-fluoro-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole (2S,3S)-tartrate 6-[(Z)-2-(6-methylpyridin-3-yl)vinyl]-9-(trifluoromethoxy)-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole 6-[2-(6-methylpiperidin-3-yl)ethyl]-9-(trifluoromethoxy)-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole 9-methyl-6-[(Z)-2-pyridin-3-ylvinyl]-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole 8-methyl-5,15-dihydro-6H-naphtho[2',3':1,2]indolizino[8,7-b]indole-9,14-dione 4-methyl-2-(trimethylsilyl)methylsulfanyl-1-azabicyclo[5.3.0]deca-2,7,9-triene 1-(N-Methyl-2-piperidyl)cyclohexan-carbonsaeureethylester 2-methyl-1,2,3,4,5,6,7,8-octahydro-2,5-indolodiazocine 9-methyl-6-[2-(2-methylphenyl)ethyl]-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole 6-[(E)-2-pyridin-3-ylvinyl]-9-(trifluoromethoxy)-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole 6-[(Z)-2-(6-methylpyridin-3-yl)vinyl]-9-(methylsulfonyl)-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole 16α-Hydroxy-21-oxo-20ξ-dihydro-cleavamin 3-benzyl-9-methoxy-1,2,3,4,5,6-hexahydro-azepino[4,5-b]indole-8-carbaldehyde tert-butyl 3,4,5,10-tetrahydroazepino[3,4-b]indole-2(1H)-carboxylate

18-(cyclopentyloxy)-19-hydroxy-9-({1-hydroxy-6,7-dihydro-5H-benzo[7]annulen-7-yl}methyl)-12-(2-hydroxyethyl)-11,13-dioxo-5,31,33-triazaheptacyclo[25.6.2.1¹⁶,²⁰.1²²,²⁶.0²,¹⁰.0⁴,⁸.0²⁸,³²]heptatriaconta-2,4(8),5,16(37),17,19,22(36),23,25,29,31-undecaene-7,28-diide

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