7,8-epoxysinogenin 3-methylglycosides
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7,8-epoxysinogenin 3-methylglycosides
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CAS No:
118004-72-1
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Formula:
C30H42O10
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Chemical Name:
7,8-epoxysinogenin 3-methylglycosides
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Synonyms:
7,8-epoxysinogenin 3-methylglycosides;7,8-ESMG;7,8beta-epoxysinogenin 3alpha-(D-methylglycoside);DTXSID60922592;(1R,3S,5S,7S,10S,11S,12R,14R,15R,18R)-12,18-Dihydroxy-7-[(2R,4S,5R,6R)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-10,14-dimethyl-15-(5-oxo-2H-furan-3-yl)-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadecan-13-one;3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-11,14-dihydroxy-12-oxo-7,8-epoxycard-20(22)-enolide
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CAS No:
Computed Properties
Molecular Weight:562.6
XLogP3:0.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:4
Exact Mass:562.27779753
Monoisotopic Mass:562.27779753
Topological Polar Surface Area:144
Heavy Atom Count:40
Complexity:1140
Defined Atom Stereocenter Count:14
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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