(3S,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
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![(3S,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b492d6ca4a654956b808fa0b065ff5fa.png "(3S,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one")
(3S,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
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CAS No:
6512-67-0
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Formula:
C21H24O7
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Chemical Name:
(3S,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
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Synonyms:
thujaplicatin methyl ether;Thujaplicatin methyl ether;(-)-thujaplicatintrimethyl ether;UNII-2VJD5SJF7V;2VJD5SJF7V;CHEMBL469917;6512-67-0;3-O-Methylthujaplicatin;DTXSID40215434;BDBM50259876;2(3H)-Furanone, dihydro-3-((4-hydroxy-3,5-dimethoxyphenyl)methyl)-4-((4-hydroxy-3-methoxyphenyl)methyl)-, (3S-trans)-;Q27894502
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CAS No:
(3S,4S)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one Basic Attributes
388.4 g/mol
388.15220310 g/mol
2VJD5SJF7V
DTXSID40215434
Computed Properties
Molecular Weight:388.4
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:388.15220310
Monoisotopic Mass:388.15220310
Topological Polar Surface Area:94.4
Heavy Atom Count:28
Complexity:499
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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