Chicoric acid
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Chicoric acid
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CAS No:
6537-80-0
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Formula:
C22H18O12
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Chemical Name:
Chicoric acid
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Synonyms:
Butanedioic acid,2,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-,(2R,3R)-;Tartaric acid,bis(3,4-dihydroxycinnamate);Butanedioic acid,2,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-,[R-(R*,R*)]-;Butanedioic acid,2,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-,(2R,3R)-;(2R,3R)-2,3-Bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]butanedioic acid;Chicoric acid;Dicaffeoyltartaric acid;Cichoric acid;135541-38-7
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CAS No:
Safety Information
NONH for all modes of transport
3
22-42/43
22-36/37-45
Xn
P261-P280-P284-P301 + P312 + P330-P304 + P340-P342 + P311
H302-H317-H334
Chicoric acid Use and Manufacturing
Chicoric Acid is an effective inhibitor of human immunodeficiency virus type-1 (HIV-1) integrase and the replication in tissues. Also a class of cannabinomimetics with CB2 receptor-dependent and independent
Computed Properties
Molecular Weight:474.4
XLogP3:2
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:11
Exact Mass:474.07982601
Monoisotopic Mass:474.07982601
Topological Polar Surface Area:208
Heavy Atom Count:34
Complexity:740
Defined Atom Stereocenter Count:2
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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