81905-83-1
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81905-83-1
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CAS No:
81905-83-1
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Formula:
C41H28O27
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Chemical Name:
81905-83-1
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Synonyms:
81905-83-1;beta-D-Glucopyranose, cyclic 3,6-(4,4',5,5',6,6'-hexahydroxy(1,1'-biphenyl)-2,2'-dicarboxylate) cyclic 2-9:4-1-(3,4,4a,9b-tetrahydro-4,4,4a,6,7-pentahydroxy-3-oxo-1,9-dibenzofurandicarboxylate) 1-(3,4,5-trihydroxybenzoate), stereoisomer;W-2889
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CAS No:
Computed Properties
Molecular Weight:952.6
XLogP3:-0.6
Hydrogen Bond Donor Count:14
Hydrogen Bond Acceptor Count:27
Rotatable Bond Count:3
Exact Mass:952.08179561
Monoisotopic Mass:952.08179561
Topological Polar Surface Area:450
Heavy Atom Count:68
Complexity:2080
Undefined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 81905-83-1
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