(5S,10R)-N-[3-(2-Amino-1H-imidazol-5-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide
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![(5S,10R)-N-[3-(2-Amino-1H-imidazol-5-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a6f1d6024fc145f5a550b269fca27479.png "(5S,10R)-N-[3-(2-Amino-1H-imidazol-5-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide")
(5S,10R)-N-[3-(2-Amino-1H-imidazol-5-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide
structure -
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CAS No:
87075-23-8
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Formula:
C16H19Br2N5O4
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Chemical Name:
(5S,10R)-N-[3-(2-Amino-1H-imidazol-5-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide
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Synonyms:
1-Oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide,N-[3-(2-amino-1H-imidazol-5-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-,(5S,10R)-;1-Oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide,N-[3-(2-amino-1H-imidazol-4-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-,trans-(+)-;1-Oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide,N-[3-(2-amino-1H-imidazol-4-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-,(5S,10R)-;(5S,10R)-N-[3-(2-Amino-1H-imidazol-5-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide;Aerophobin 2;Aerophobin II
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CAS No:
(5S,10R)-N-[3-(2-Amino-1H-imidazol-5-yl)propyl]-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide Basic Attributes
505.2 g/mol
505.16
DTXSID30236113
Computed Properties
Molecular Weight:505.2
XLogP3:0.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:504.97833
Monoisotopic Mass:502.98038
Topological Polar Surface Area:135
Heavy Atom Count:27
Complexity:698
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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