Isofistularin-3
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Isofistularin-3
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CAS No:
87099-50-1
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Formula:
C31H30Br6N4O11
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Chemical Name:
Isofistularin-3
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Synonyms:
isofistularin-3;Isofistularin-3;Fistularin 3;FISTULARIN-3;87099-50-1;CHEMBL3236757;1-Oxa-2-azaspiro(4.5)deca-2,6,8-triene-3-carboxamide, 7,9-dibromo-N-(3-(2,6-dibromo-4-(2-((((5S,10R)-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro(4.5)deca-2,6,8-trien-3-yl)carbonyl)amino)-1-hydroxyethyl)phenoxy)-2-hydroxypropyl)-10-hydroxy-8-methoxy-, (5S,10R)-
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CAS No:
Computed Properties
Molecular Weight:1114.0
XLogP3:1.8
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:12
Exact Mass:1113.69499
Monoisotopic Mass:1107.70113
Topological Polar Surface Area:210
Heavy Atom Count:52
Complexity:1610
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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