N-[4-[(2S,3R,4R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyphenyl]-5-(dimethylamino)naphthalene-1-sulfonamide
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N-[4-[(2S,3R,4R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyphenyl]-5-(dimethylamino)naphthalene-1-sulfonamide
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CAS No:
94367-65-4
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Formula:
C30H38N2O13S
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Chemical Name:
N-[4-[(2S,3R,4R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyphenyl]-5-(dimethylamino)naphthalene-1-sulfonamide
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Synonyms:
DNS-PAPL;N-(5-dimethylaminonaphthalene-1-sulfonyl)-4-aminophenyl-beta-lactoside;Dns-papl;94367-65-4;DTXSID50915594;N-(5-Dimethylaminonaphthalene-1-sulfonyl)-4-aminophenyl-beta-lactoside;1-Naphthalenesulfonamide, 5-(dimethylamino)-N-(4-((4-O-beta-D-galactopyranosyl-beta-D-glucopyranosyl)oxy)phenyl)-, (S)-;5-(Dimethylamino)-N-{4-[(4-O-hexopyranosylhexopyranosyl)oxy]phenyl}naphthalene-1-sulfonamide
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CAS No:
N-[4-[(2S,3R,4R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyphenyl]-5-(dimethylamino)naphthalene-1-sulfonamide Basic Attributes
666.7 g/mol
666.20946044 g/mol
Computed Properties
Molecular Weight:666.7
XLogP3:-0.5
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:10
Exact Mass:666.20946044
Monoisotopic Mass:666.20946044
Topological Polar Surface Area:236
Heavy Atom Count:46
Complexity:1070
Defined Atom Stereocenter Count:9
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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