(3R,4R)-3-[[3-[[2-chloroethyl(methyl)amino]methyl]-4-hydroxy-5-methoxyphenyl]methyl]-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one;hydrochloride
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(3R,4R)-3-[[3-[[2-chloroethyl(methyl)amino]methyl]-4-hydroxy-5-methoxyphenyl]methyl]-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one;hydrochloride
structure -
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CAS No:
26788-57-8
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Formula:
C25H33Cl2NO6
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Chemical Name:
(3R,4R)-3-[[3-[[2-chloroethyl(methyl)amino]methyl]-4-hydroxy-5-methoxyphenyl]methyl]-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one;hydrochloride
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Synonyms:
Arctigenin mustard;26788-57-8;2(3H)-Furanone, 3-((3-(((2-chloroethyl)methylamino)methyl)-4-hydroxy-5-methoxyphenyl)methyl)-4-((3,4-dimethoxyphenyl)methyl)dihydro-, hydrochloride, (3R-trans)-;Chloroethylmethylaminomethyl-arctigenin;AgM;3-(5-(((2-Chloroethyl)methylamino)methyl)vanillyl)dihydro-4-veratryl-2(3H)-furanone HCl;2(3H)-Furanone, 3-(5-(((2-chloroethyl)methylamine)methyl)vanillyl)dihydro-4-veratryl-, hydrochloride;3-((3-(((2-Chloroethyl)methylamino)methyl)-4-hydroxy-5-methoxyphenyl)methyl)-4-((3,4-dimethoxyphenyl)methyl)dihydro-2(3H)-furanone hydrochloride, (3R-trans)-;DTXSID90181296
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CAS No:
(3R,4R)-3-[[3-[[2-chloroethyl(methyl)amino]methyl]-4-hydroxy-5-methoxyphenyl]methyl]-4-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one;hydrochloride Basic Attributes
514.4 g/mol
513.1684932 g/mol
DTXSID90181296
Computed Properties
Molecular Weight:514.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:513.1684932
Monoisotopic Mass:513.1684932
Topological Polar Surface Area:77.5
Heavy Atom Count:34
Complexity:609
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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