apiopaeonoside
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apiopaeonoside
structure -
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CAS No:
100291-86-9
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Formula:
C20H28O12
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Chemical Name:
apiopaeonoside
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Synonyms:
apiopaeonoside;apiopeonoside;paeonol-(apio-beta-furanosyl(1-6)glucopyranoside);1-[2-[6-[[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-methoxyphenyl]ethanone;DTXSID40905328;BCP10893;HY-N2161;CS-0019461
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CAS No:
Characteristics
185
-0.22
1.55±0.1 g/cm3 (20 ºC 760 Torr)
765.9±60.0 °C(Predicted)
267.0±26.4 °C
1.629
Computed Properties
Molecular Weight:460.4
XLogP3:-2.4
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:460.15807632
Monoisotopic Mass:460.15807632
Topological Polar Surface Area:185
Heavy Atom Count:32
Complexity:634
Undefined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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