4-[1-[4-[2-(diethylamino)ethoxy]phenyl]-1-hydroxy-2-(4-methoxyphenyl)butyl]phenol;2-hydroxypropane-1,2,3-tricarboxylic acid
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![4-[1-[4-[2-(diethylamino)ethoxy]phenyl]-1-hydroxy-2-(4-methoxyphenyl)butyl]phenol;2-hydroxypropane-1,2,3-tricarboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/cba0bb9791f145debf35cdd73c89f0b4.png "4-[1-[4-[2-(diethylamino)ethoxy]phenyl]-1-hydroxy-2-(4-methoxyphenyl)butyl]phenol;2-hydroxypropane-1,2,3-tricarboxylic acid")
4-[1-[4-[2-(diethylamino)ethoxy]phenyl]-1-hydroxy-2-(4-methoxyphenyl)butyl]phenol;2-hydroxypropane-1,2,3-tricarboxylic acid
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CAS No:
35263-96-8
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Formula:
C35H45NO11
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Chemical Name:
4-[1-[4-[2-(diethylamino)ethoxy]phenyl]-1-hydroxy-2-(4-methoxyphenyl)butyl]phenol;2-hydroxypropane-1,2,3-tricarboxylic acid
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Synonyms:
UNII-6198URY27G;6198URY27G;35263-96-8;alpha-(4-(2-(Diethylamino)ethoxy)phenyl)-beta-ethyl-alpha-(4-hydroxyphenyl)-4-methoxy benzeneethanol citrate (1:1);H-1270;Phenethyl alcohol, alpha-(p-(2-(diethylamino)ethoxy)phenyl)-beta-ethyl-alpha-(p-hydroxyphenyl)-p-methoxy-, citrate;SCHEMBL17164707;DTXSID70956707;A6674;Q27263324;2-Hydroxypropane-1,2,3-tricarboxylic acid--4-[1-{4-[2-(diethylamino)ethoxy]phenyl}-1-hydroxy-2-(4-methoxyphenyl)butyl]phenol (1/1)
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CAS No:
4-[1-[4-[2-(diethylamino)ethoxy]phenyl]-1-hydroxy-2-(4-methoxyphenyl)butyl]phenol;2-hydroxypropane-1,2,3-tricarboxylic acid Basic Attributes
655.7 g/mol
655.29926125 g/mol
6198URY27G
Computed Properties
Molecular Weight:655.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:17
Exact Mass:655.29926125
Monoisotopic Mass:655.29926125
Topological Polar Surface Area:194
Heavy Atom Count:47
Complexity:774
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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