methyl (2S,4S,E)-4-(2-(((1S,2S,3S,4R)-4-(1,3-dihydroxypropan-2-yl)-3-((2-((2S,4S,E)-3-ethylidene-5-(methoxycarbonyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-4-yl)acetoxy)methyl)-2-methylcyclopentyl)oxy)-2-oxoethyl)-3-ethylidene-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate

Catalog No. :: ACGCRR097
CAS No. :: 190896-95-8
Molecular Formula :: C44H64O24
Molecular Weight :: 976.97

IUPAC Name:methyl (2S,4S,E)-4-(2-(((1S,2S,3S,4R)-4-(1,3-dihydroxypropan-2-yl)-3-((2-((2S,4S,E)-3-ethylidene-5-(methoxycarbonyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-4-yl)acetoxy)methyl)-2-methylcyclopentyl)oxy)-2-oxoethyl)-3-ethylidene-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate

methyl (2S,4S,E)-4-(2-(((1S,2S,3S,4R)-4-(1,3-dihydroxypropan-2-yl)-3-((2-((2S,4S,E)-3-ethylidene-5-(methoxycarbonyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-4-yl)acetoxy)methyl)-2-methylcyclopentyl)oxy)-2-oxoethyl)-3-ethylidene-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate structure diagram

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Product Name	methyl (2S,4S,E)-4-(2-(((1S,2S,3S,4R)-4-(1,3-dihydroxypropan-2-yl)-3-((2-((2S,4S,E)-3-ethylidene-5-(methoxycarbonyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-4-yl)acetoxy)methyl)-2-methylcyclopentyl)oxy)-2-oxoethyl)-3-ethylidene-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate
IUPAC Name	methyl (2S,4S,E)-4-(2-(((1S,2S,3S,4R)-4-(1,3-dihydroxypropan-2-yl)-3-((2-((2S,4S,E)-3-ethylidene-5-(methoxycarbonyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-4-yl)acetoxy)methyl)-2-methylcyclopentyl)oxy)-2-oxoethyl)-3-ethylidene-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate
Molecular Formula	C44H64O24
Molecular Weight	976.97
SMILES	C/C=C1/[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)OC[C@@H]1[C@H](C)[C@@H](OC(=O)C[C@@H]2C(C(=O)OC)=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)/C2=C/C)C[C@H]1C(CO)CO
InChI Key	QGVKUNWDVOEJOC-DDFLQQJCSA-N
Synonym	Jarsuroside C;2H-Pyran-4-acetic acid, 3-ethylidene-2-(β-D-glucopyranosyloxy)-3,4-dihydro-5-(methoxycarbonyl)-, [(1S,2S,3S,5R)-3-[[[(2S,3E,4S)-3-ethylidene-2-(β-D-glucopyranosyloxy)-3,4-dihydro-5-(methoxycarbonyl)-2H-pyran-4-yl]acetyl]oxy]-5-[2-hydroxy-1-(hydroxymethyl)ethyl]-2-methylcyclopentyl]methyl ester, (2S,...;Jarsuroside C >=95% (LC/MS-ELSD)
CAS No.	190896-95-8

Synthetic Route by SureRoute

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ACGCRR097190896-95-8

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Synthetic Route by SureRoute

1. ACGCRR097 Molecular Building Block Synthetic Route

2. ACGCRR097 Molecular Building Block Synthetic Route

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Synthetic Route by SureRoute

Nudifloside B

Jasminin

methyl (2S,4S,E)-4-(2-(((1S,2R,3R,5R)-5-(1,3-dihydroxypropan-2-yl)-3-hydroxy-2-methylcyclopentyl)methoxy)-2-oxoethyl)-3-ethylidene-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate

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