(2R,3S,4R,5R,6R)-6-(3,4-Dihydroxyphenethoxy)-4-hydroxy-2-(hydroxymethyl)-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate

Catalog No. :: ACBQST956
CAS No. :: 1802727-92-9
Molecular Formula :: C29H36O15
Molecular Weight :: 624.59

IUPAC Name:(2R,3S,4R,5R,6R)-6-(3,4-dihydroxyphenethoxy)-4-hydroxy-2-(hydroxymethyl)-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate

(2R,3S,4R,5R,6R)-6-(3,4-Dihydroxyphenethoxy)-4-hydroxy-2-(hydroxymethyl)-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate structure diagram

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Product Name	(2R,3S,4R,5R,6R)-6-(3,4-Dihydroxyphenethoxy)-4-hydroxy-2-(hydroxymethyl)-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate
IUPAC Name	(2R,3S,4R,5R,6R)-6-(3,4-dihydroxyphenethoxy)-4-hydroxy-2-(hydroxymethyl)-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate
Molecular Formula	C29H36O15
Molecular Weight	624.59
SMILES	C[C@@H]1O[C@@H](O[C@H]2[C@H](OCCC3=CC=C(O)C(O)=C3)O[C@H](CO)[C@@H](OC(=O)/C=C/C3=CC(O)=C(O)C=C3)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChI Key	NFBNGFRFMOYOCE-QQLYGORSSA-N
Synonym	Magnoloside M
CAS No.	1802727-92-9

Safety Data

Pictogram
Signal Word: Achtung
Hazard Statement(s): H302-H315-H319
Precautionary Statement(s): P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501

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ACBQST9561802727-92-9

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ACBQST9561802727-92-9

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(2R,3S,4R,5R,6R)-6-(3,4-Dihydroxyphenethoxy)-4-hydroxy-2-(hydroxymethyl)-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate

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1. ACBQST956 Molecular Building Block Synthetic Route

2. ACBQST956 Molecular Building Block Synthetic Route

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(2R,3S,4R,5R,6R)-6-(3,4-Dihydroxyphenethoxy)-4-hydroxy-2-(hydroxymethyl)-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate

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Safety Data

Synthetic Route by SureRoute

(2R,3S,4R,5R,6R)-6-(3,4-Dihydroxyphenethoxy)-4-hydroxy-2-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate

2-(3,4-dihydroxyphenethoxy)-5-hydroxy-6-(((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-3-((3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-4-yl 3-(3,4-dihydroxyphenyl)acrylate

(E)-(2R,3R,4R,5R,6R)-2-(3,4-Dihydroxyphenethoxy)-5-hydroxy-6-(hydroxymethyl)-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-4-yl 3-(3,4-dihydroxyphenyl)acrylate

(2R,3R,4R,5R,6R)-4-(((2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-(3,4-dihydroxyphenethoxy)-5-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate

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