BRN 1677055
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BRN 1677055
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CAS No:
61066-22-6
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Formula:
C44H76N2O14S
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Chemical Name:
BRN 1677055
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Synonyms:
(9S)-9-Deoxo-9-(((2-methylphenyl)sulfonyl)amino)erythromycin;BRN 1677055;N-(2-Methylbenzenesulfonyl)erythromycylamine;61066-22-6;Erythromycin, 9-deoxo-9-(((2-methylphenyl)sulfonyl)amino)-, (9S)-;N-[(2R,3S,4R,5S,6S,7R,9R,10R,11S,12S,13R)-10-[(2R,3S,4R,6S)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,9-trihydroxy-12-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-14-oxo-oxacyclotetradec-6-yl]-2
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CAS No:
Computed Properties
Molecular Weight:889.1
XLogP3:5.4
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:10
Exact Mass:888.50172628
Monoisotopic Mass:888.50172628
Topological Polar Surface Area:231
Heavy Atom Count:61
Complexity:1540
Defined Atom Stereocenter Count:19
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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