(7S,8aS,10aS)-3,7-dibromo-8,8,10a-trimethyl-6,7,8a,9-tetrahydro-5H-xanthen-2-ol
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(7S,8aS,10aS)-3,7-dibromo-8,8,10a-trimethyl-6,7,8a,9-tetrahydro-5H-xanthen-2-ol
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CAS No:
124962-12-5
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Formula:
C16H20Br2O2
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Chemical Name:
(7S,8aS,10aS)-3,7-dibromo-8,8,10a-trimethyl-6,7,8a,9-tetrahydro-5H-xanthen-2-ol
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Synonyms:
4-isocymobarbatol;cymobarbatol;4-Isocymobarbatol;4-Isocymbarbatol;124962-12-5;CHEMBL485051;SCHEMBL15980569;(7S,8aS,10aS)-3,7-dibromo-8,8,10a-trimethyl-6,7,8a,9-tetrahydro-5H-xanthen-2-ol
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CAS No:
(7S,8aS,10aS)-3,7-dibromo-8,8,10a-trimethyl-6,7,8a,9-tetrahydro-5H-xanthen-2-ol Basic Attributes
404.14 g/mol
403.98096 g/mol
Computed Properties
Molecular Weight:404.14
XLogP3:5.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:403.98096
Monoisotopic Mass:401.98301
Topological Polar Surface Area:29.5
Heavy Atom Count:20
Complexity:387
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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