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Home > Encyclopedia > 4-[[dithiocarboxy-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]methyl]benzoic acid

4-[[dithiocarboxy-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]methyl]benzoic acid

4-[[dithiocarboxy-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]methyl]benzoic acid structure

4-[[dithiocarboxy-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]methyl]benzoic acid 

structure
  • CAS No:

    127531-18-4

  • Formula:

    C15H21NO7S2

  • Chemical Name:

    4-[[dithiocarboxy-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]methyl]benzoic acid

  • Synonyms:

    N-4-carboxybenzylglucamine dithiocarbamate;N-CBGD;N-p-carboxybenzyl-D-glucamine dithiocarbamate;N-4-Carboxybenzylglucamine dithiocarbamate;127531-18-4;N-Cbgd;CBGD;N-p-Carboxybenzyl-D-glucamine dithiocarbamate;DTXSID60155601;D-Glucitol, 1-(((4-carboxyphenyl)methyl)(dithiocarboxy)amino)-1-deoxy-

4-[[dithiocarboxy-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]methyl]benzoic acid Basic Attributes

391.5 g/mol

391.07594436 g/mol

DTXSID60155601

Characteristics

175 Ų

Drug Information

N-4-carboxybenzylglucamine dithiocarbamate

Computed Properties

Molecular Weight:391.5
XLogP3:-1.2
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:9
Exact Mass:391.07594436
Monoisotopic Mass:391.07594436
Topological Polar Surface Area:175
Heavy Atom Count:25
Complexity:446
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-[[dithiocarboxy-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]methyl]benzoic acid

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