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22487-36-1

22487-36-1 Structure

22487-36-1 Structure
IdentificationBack Directory
[Name]

(1R,2S,6S,9S)-9-methyl-2-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxabicyclo[4.3.0]non-4-ene-5-carboxylic acid
[CAS]

22487-36-1
[Synonyms]

Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-, (1S,4aS,7S,7aR)-
(1R,2S,6S,9S)-9-methyl-2-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxabicyclo[4.3.0]non-4-ene-5-carboxylic acid
[Molecular Formula]

C16H24O9
[MOL File]

22487-36-1.mol
[Molecular Weight]

360.36
Chemical PropertiesBack Directory
[Melting point ]

88-90 °C
[Boiling point ]

597.2±50.0 °C(Predicted)
[density ]

1.52±0.1 g/cm3(Predicted)
[pka]

4.65±0.60(Predicted)
Hazard InformationBack Directory
[Definition]

ChEBI: 7-deoxyloganic acid is a cyclopentapyran that is 1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid substituted at positions 1 and 7 by beta-D-glucosyloxy and methyl groups respectively (the 1S,4aS,7S,7aR-diatereomer). It has a role as a plant metabolite. It is a beta-D-glucoside, a cyclopentapyran, a monoterpene glycoside, a monosaccharide derivative, an iridoid monoterpenoid and an alpha,beta-unsaturated monocarboxylic acid. It is functionally related to a 7-deoxyloganetic acid. It is a conjugate acid of a 7-deoxyloganate.
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