(4AS,5R,6S)-5-ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-3-hydroxy-1H,3H-pyrano[3,4-c]pyran-1-one

Catalog No. :: ACQLXZ306
CAS No. :: 60077-46-5
Molecular Formula :: C16H22O10
Molecular Weight :: 374.34

IUPAC Name:(4aS,5R,6S)-3-hydroxy-6-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-vinyl-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one

(4AS,5R,6S)-5-ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-3-hydroxy-1H,3H-pyrano[3,4-c]pyran-1-one structure diagram

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Product Information

Product Name	(4AS,5R,6S)-5-ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-3-hydroxy-1H,3H-pyrano[3,4-c]pyran-1-one
IUPAC Name	(4aS,5R,6S)-3-hydroxy-6-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-vinyl-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one
Molecular Formula	C16H22O10
Molecular Weight	374.34
SMILES	C=C[C@@H]1[C@@]2([H])C(C(OC(C2)O)=O)=CO[C@H]1O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO
InChI Key	LCTYGGXMQYUYHL-UEMOXOMHSA-N
Synonym	Secologanic acid;1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-3-hydroxy-, (4aS,5R,6S)-;inhibit,Inhibitor,Secologanic acid;Secologanic acid, 10 mM in DMSO
CAS No.	60077-46-5

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ACQLXZ30660077-46-5

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ACQLXZ30660077-46-5

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(4AS,5R,6S)-5-ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-3-hydroxy-1H,3H-pyrano[3,4-c]pyran-1-one

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Synthetic Route by SureRoute

1. ACQLXZ306 Molecular Building Block Synthetic Route

2. ACQLXZ306 Molecular Building Block Synthetic Route

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(4AS,5R,6S)-5-ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-3-hydroxy-1H,3H-pyrano[3,4-c]pyran-1-one

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Synthetic Route by SureRoute

Vogeloside

(3S,4aS,5R,6S)-3-methoxy-6-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-vinyl-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one

(4aS,5R,6S)-6-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5-vinyl-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one

methyl (2S,3R,4S)-4-(2,2-dimethoxyethyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-vinyl-3,4-dihydro-2H-pyran-5-carboxylate

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