[1-[(3,4-dihydroxyphenyl)methyl]-7-hydroxyisoquinolin-6-yl] hydrogen sulfate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
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![[1-[(3,4-dihydroxyphenyl)methyl]-7-hydroxyisoquinolin-6-yl] hydrogen sulfate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2e84cd2defa04f26999ca2b9d2046230.png "[1-[(3,4-dihydroxyphenyl)methyl]-7-hydroxyisoquinolin-6-yl] hydrogen sulfate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol")
[1-[(3,4-dihydroxyphenyl)methyl]-7-hydroxyisoquinolin-6-yl] hydrogen sulfate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
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CAS No:
66944-58-9
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Formula:
C23H30N2O12S
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Chemical Name:
[1-[(3,4-dihydroxyphenyl)methyl]-7-hydroxyisoquinolin-6-yl] hydrogen sulfate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol
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Synonyms:
meglumine papaveroline 6'-sulfonate;papaveroline 6'-sulphonic acid N-methylglucamine salt;UTEN;66944-58-9;UTEN;DTXSID40985685;Meglumine papaveroline 6'-sulfonate;A9811;Papaveroline 6'-sulphonic acid N-methylglucamine salt;1-[(3,4-Dihydroxyphenyl)methyl]-7-hydroxyisoquinolin-6-yl hydrogen sulfate--1-deoxy-1-(methylamino)hexitol (1/1);D-Glucitol, 1-deoxy-1-(methylamino)-, compd. with 1-((3,4-dihydroxyphenyl)methyl)-6,7-isoquinolinediol 6-(hydrogen sulfate) (1:1)
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CAS No:
[1-[(3,4-dihydroxyphenyl)methyl]-7-hydroxyisoquinolin-6-yl] hydrogen sulfate;(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol Basic Attributes
558.6 g/mol
558.15194557 g/mol
Computed Properties
Molecular Weight:558.6
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:10
Exact Mass:558.15194557
Monoisotopic Mass:558.15194557
Topological Polar Surface Area:259
Heavy Atom Count:38
Complexity:685
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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