1-[3-[4-[6-[[17-Benzyl-5-(dihydroxymethyl)-15-hydroxy-29-methoxy-12-methyl-23-oxo-2,20-dioxapentacyclo[24.3.1.04,9.07,16.08,13]triaconta-1(29),4,6,8,10,13,15,26(30),27-nonaen-18-yn-21-yl]methyl]-4-hydroxycyclohexa-2,4-dien-1-yl]butyl]-2-pentylphenyl]-2-methylguanidine

分子结构分类

有机化合物 - 苯类化合物 - 非那烯类

中文名称

——

中文别名

——

英文名称

1-[3-[4-[6-[[17-Benzyl-5-(dihydroxymethyl)-15-hydroxy-29-methoxy-12-methyl-23-oxo-2,20-dioxapentacyclo[24.3.1.04,9.07,16.08,13]triaconta-1(29),4,6,8,10,13,15,26(30),27-nonaen-18-yn-21-yl]methyl]-4-hydroxycyclohexa-2,4-dien-1-yl]butyl]-2-pentylphenyl]-2-methylguanidine

英文别名

1-[3-[4-[6-[[17-benzyl-5-(dihydroxymethyl)-15-hydroxy-29-methoxy-12-methyl-23-oxo-2,20-dioxapentacyclo[24.3.1.04,9.07,16.08,13]triaconta-1(29),4,6,8,10,13,15,26(30),27-nonaen-18-yn-21-yl]methyl]-4-hydroxycyclohexa-2,4-dien-1-yl]butyl]-2-pentylphenyl]-2-methylguanidine

CAS

——

化学式

C₆₂H₇₁N₃O₈

mdl

——

分子量

986.2

InChiKey

WVURBZUOQNHINT-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

12.4
重原子数：

73
可旋转键数：

17
环数：

9.0
sp3杂化的碳原子比例：

0.39
拓扑面积：

176
氢给体数：

6
氢受体数：

9

同类化合物

迫萘合環己-1,3-二酮赫金青霉素萘嵌苯酮富拉烯酮 9-羟基-萘嵌苯-1-酮 9-甲基氨基-萘嵌苯-1-酮 9-巯基-萘嵌苯-1-酮 9-去甲基FR-901235 9-二甲基氨基-1H-萘嵌苯-1-酮 9-丁氧基-1H-萘嵌苯-1-酮 6b,7a-二氢-7H-环丙并[a]苊烯-7-胺盐酸盐(1:1) 6-羟基-3-甲基-1H-萘嵌苯-1-酮 6-羟基-1H-萘嵌苯-1-酮 6-溴-1H-萉 6-氨基-1-萉酮 3-羟基-1H-PHENALEN-1-酮 2-甲氧基非那烯酮 2-甲基-1-氧代-1H-非那烯-3-乙酸 2-氯-6-(3-羟基丙基)氨基-1H-萉-1-酮 2,3-二氢-6-甲氧基萘嵌苯-1-酮 2,3-二氢-1H-萉 2,3-二氢-1H-苯并-1-酮 1H-非那烯并[2,1-d][1,3]噻唑 1H-非那烯 1H-萘嵌苯-1-酮腙 1-硫酮-9-甲基氨基-非那烯 (R)-8,9-二氢-4,5,6,7-四羟基-1,8,8,9-四甲基-3H-非那烯并(1,2-b)呋喃-3-酮 2-hydroxy-2-piperidino-phenalene-1,3-dione 9-[(4-pyrimidin-2-yl)piperazin-1-yl]-1H-phenalen-1-one N-[2-(4,9-dimethoxy-2,3-dihydro-1H-1-phenalenyl)ethyl]butanamide N-[2-(9-methoxy-2,3-dihydro-1H-1-phenalenyl)ethyl]butanamide 9-methyl-9-(2-methylpropenyl)-8,9-dihydrophenaleno[1,2-b]furan-7-one 3-((cyclohexylmethyl)amino)-6-(cyclohexylthio)-1-oxo-1H-phenalene-2-carbonitrile 9-(4-benzylpiperazin-1-yl)-1H-phenalen-1-one perchlorophenalenyl radical 6-((4-bromophenyl)thio)-1-oxo-1H-phenalene-2,3-dicarbonitrile methyl 3-((6-((4-bromophenyl)thio)-2-cyano-1-oxo-1H-phenalen-3-yl)amino)propanoate 3-((6-((4-bromophenyl)thio)-2-cyano-1-oxo-1H-phenalen-3-yl)amino)propanoic acid 3-((6-((4-bromophenyl)thio)-2-cyano-1-oxo-1H-phenalen-3-yl)amino)-N-(2-(2-hydroxyethoxy)ethyl)propanamide 1,1-dimethyl-1a,11b-dihydro-1H-benzo[k]cyclopropa[4,5]cyclopent[1,2,3-cd]fluoranthene 6-(cyclopentylthio)-1-oxo-1H-phenalene-2,3-dicarbonitrile 5-propyl-9-hydroxyphenalenone N-[2-(4,9-dimethoxy-2,3-dihydro-1H-1-phenalenyl)ethyl]propanamide N-[2-(4-methoxy-2,3-dihydro-1H-1-phenalenyl)ethyl]propanamide N-benzyl-1,2,3,10-tetrahydronaphtho[1,8-fg]indol-7-yl trifluoromethanesulfonate N-benzyl-7-ethyl-1,2,3,10-tetrahydronaphtho[1,8-fg]indole 1-oxo-1H-phenalene-2,3-dicarbonitrile 1-((1-oxo-1H-phenalen-2-yl)methyl)pyridinium chloride 9-[(2-hydroxyethyl)(methyl)amino]-1H-phenalen-1-one 6-phenylsulfanyl-2,3-dicyanophenalenone

1-[3-[4-[6-[[17-Benzyl-5-(dihydroxymethyl)-15-hydroxy-29-methoxy-12-methyl-23-oxo-2,20-dioxapentacyclo[24.3.1.04,9.07,16.08,13]triaconta-1(29),4,6,8,10,13,15,26(30),27-nonaen-18-yn-21-yl]methyl]-4-hydroxycyclohexa-2,4-dien-1-yl]butyl]-2-pentylphenyl]-2-methylguanidine

分子结构分类

计算性质

同类化合物

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