5-[(2S)-2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-2-methoxyphenol
5-[(2S)-2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-2-methoxyphenol
Molecular Identity
5-[(2S)-2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-2-methoxyphenol
5-[(2S)-2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-2-methoxyphenol
PubChem CID: 100154
2D Structure
Properties
C18H22O6
Molecular Formula
334.40
Molecular Weight
g/mol
334.1416
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
77.4
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
6
H-Bond Acceptors
351
Complexity
SMILES
Canonical SMILES
SMILES: COC1=C(C=C(C=C1)CC(C2=CC(=C(C(=C2)OC)OC)OC)O)OIsomeric SMILES
SMILES: COC1=C(C=C(C=C1)C[C@@H](C2=CC(=C(C(=C2)OC)OC)OC)O)OSynonyms(8)
CA4P5-[(2S)-2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-2-methoxyphenolSCHEMBL29356562LGZKGOGODCLQHG-ZDUSSCGKSA-NAKOS015967221DB05284Q27095579(R,S)-5-[2-Hydroxy-2-(3,4,5-trimethoxy-phenyl)-ethyl]-2-methoxy-phenol
Data from PubChem (NCBI)
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Molecular Structure
5-[(2S)-2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-2-methoxyphenol
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Drug Network
Trials and conditions connected to 5-[(2S)-2-hydroxy-2-(3,4,5-trimethoxyphenyl)ethyl]-2-methoxyphenol
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