Compound Q&A

What are the physical and chemical properties of (1aS,1bS,2S,5aR,6S,6aS)-2-(beta-D-Glucopyranosyloxy)-1a-(hydroxymethyl)-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-6-yl (2E)-3-(3-hydroxy-4-methoxyphenyl)acrylate (CAS: 51005-44-8)?

Answer

(1aS,1bS,2S,5aR,6S,6aS)-2-(beta-D-Glucopyranosyloxy)-1a-(hydroxymethyl)-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-6-yl (2E)-3-(3-hydroxy-4-methoxyphenyl)acrylate
This compound is a cyclic ether with a sugar moiety and an acrylate ester. It has a molecular weight of approximately 530.4 g/mol. The compound is poorly soluble in water but soluble in organic solvents like ethanol and acetone. It is reactive towards nucleophiles and can undergo acid-catalyzed ring-opening reactions. It crystallizes in the form of white or off-white crystals.

About

CAS No 51005-44-8
English Name (1aS,1bS,2S,5aR,6S,6aS)-2-(beta-D-Glucopyranosyloxy)-1a-(hydroxymethyl)-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-6-yl (2E)-3-(3-hydroxy-4-methoxyphenyl)acrylate
Molecular Formula C25H30O13
Molecular Weight 538.5 g/mol
SMILES COC1=CC=C(\C=C\C(=O)O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]3[C@H]2C=CO[C@H]3O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1O
InChIKey LRHHPZILMPIMIY-GGKKSNITSA-N
Last Updated: 2025-10-20 00:35

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