BENZO(A)PYRENYL-7-GLUCURONIDE
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BENZO(A)PYRENYL-7-GLUCURONIDE
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CAS No:
82298-37-1
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Formula:
C26H20O7
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Chemical Name:
BENZO(A)PYRENYL-7-GLUCURONIDE
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Synonyms:
CCRIS 4082;Benzo(a)pyrene-7-glucuronide;Benzo(a)pyrenyl-7-glucuronide;BENZO[A]PYRENE-7-GLUCURONIDE;DTXSID401002598;LS-188792;Benzo[pqr]tetraphen-7-yl hexopyranosiduronic acid
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CAS No:
Computed Properties
Molecular Weight:444.4
XLogP3:4.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:444.12090297
Monoisotopic Mass:444.12090297
Topological Polar Surface Area:116
Heavy Atom Count:33
Complexity:744
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes