Erinacine A
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Erinacine A
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CAS No:
156101-08-5
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Formula:
C25H36O6
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Chemical Name:
Erinacine A
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Synonyms:
Cyclohept[e]indene-8-carboxaldehyde,2,3,3a,4,5,5a,6,7-octahydro-3a,5a-dimethyl-1-(1-methylethyl)-6-(β-D-xylopyranosyloxy)-,(3aR,5aR,6S)-;Cyclohept[e]indene-8-carboxaldehyde,2,3,3a,4,5,5a,6,7-octahydro-3a,5a-dimethyl-1-(1-methylethyl)-6-(β-D-xylopyranosyloxy)-,[3aR-(3aα,5aβ,6α)]-;(3aR,5aR,6S)-2,3,3a,4,5,5a,6,7-Octahydro-3a,5a-dimethyl-1-(1-methylethyl)-6-(β-D-xylopyranosyloxy)cyclohept[e]indene-8-carboxaldehyde;Erinacin A;(+)-Erinacin A;Erinacine A;210685-65-7
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CAS No:
Computed Properties
Molecular Weight:432.5
XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:432.25118886
Monoisotopic Mass:432.25118886
Topological Polar Surface Area:96.2
Heavy Atom Count:31
Complexity:826
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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