Emicymarin
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Emicymarin
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CAS No:
514-42-1
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Formula:
C30H46O9
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Chemical Name:
Emicymarin
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Synonyms:
Card-20(22)-enolide,3-[(6-deoxy-3-O-methyl-β-D-galactopyranosyl)oxy]-5,14-dihydroxy-,(3β,5β)-;Emicymarin;(3β,5β)-3-[(6-Deoxy-3-O-methyl-β-D-galactopyranosyl)oxy]-5,14-dihydroxycard-20(22)-enolide;α-Emicymarin;17αH-Emicymarin;31567-08-5;1206467-32-4
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CAS No:
Computed Properties
Molecular Weight:550.7
XLogP3:0.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:550.31418304
Monoisotopic Mass:550.31418304
Topological Polar Surface Area:135
Heavy Atom Count:39
Complexity:1020
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of Emicymarin
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