Asperulosidic acid
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Asperulosidic acid
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CAS No:
25368-11-0
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Formula:
C18H24O12
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Chemical Name:
Asperulosidic acid
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Synonyms:
Cyclopenta[c]pyran-4-carboxylic acid,7-[(acetyloxy)methyl]-1-(β-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-,(1S,4aS,5S,7aS)-;Cyclopenta[c]pyran-4-carboxylic acid,1α-(β-D-glucopyranosyloxy)-1,4aα,5,7aα-tetrahydro-5β-hydroxy-7-(hydroxymethyl)-,7-acetate;Cyclopenta[c]pyran-4-carboxylic acid,7-[(acetyloxy)methyl]-1-(β-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-,[1S-(1α,4aα,5β,7aα)]-;(1S,4aS,5S,7aS)-7-[(Acetyloxy)methyl]-1-(β-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxycyclopenta[c]pyran-4-carboxylic acid;Asperulosidic acid
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CAS No:
Description
Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1].ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2].
Asperulosidic acid is a glycoside and an iridoid monoterpenoid.
Computed Properties
Molecular Weight:432.4
XLogP3:-3.2
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:7
Exact Mass:432.12677620
Monoisotopic Mass:432.12677620
Topological Polar Surface Area:192
Heavy Atom Count:30
Complexity:733
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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