CHEBI:75512 - 5-bromo-4-chloro-3-indolyl β-D-glucosaminide

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ChEBI Name 5-bromo-4-chloro-3-indolyl β-D-glucosaminide ChEBI ID CHEBI:75512 ChEBI ASCII Name 5-bromo-4-chloro-3-indolyl beta-D-glucosaminide Definition An indolyl carbohydrate that is the β-D-glucosaminide of indoxyl in which the indole moiety is substituted at positions 4 and 5 by chlorine and bromine, respectively. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C14H16BrClN2O5 Net Charge 0 Average Mass 407.64400 Monoisotopic Mass 405.99311 InChI InChI=1S/C14H16BrClN2O5/c15-5-1-2-6-9(10(5)16)7(3-18-6)22-14-11(17)13(21)12(20)8(4-19)23-14/h1-3,8,11-14,18-21H,4,17H2/t8-,11-,12-,13-,14-/m1/s1 InChIKey PFLXIUOIVYGOQQ-LXOGICJWSA-N SMILES [H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1N)Oc1c[nH]c2ccc(Br)c(Cl)c12 Roles Classification Biological Role(s): mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). (via D-glucosaminide ) View more via ChEBI Ontology ChEBI Ontology Outgoing 5-bromo-4-chloro-3-indolyl β-D-glucosaminide (CHEBI:75512) has functional parent indoxyl (CHEBI:17840) 5-bromo-4-chloro-3-indolyl β-D-glucosaminide (CHEBI:75512) is a D-glucosaminide (CHEBI:35373) 5-bromo-4-chloro-3-indolyl β-D-glucosaminide (CHEBI:75512) is a bromoindole (CHEBI:52514) 5-bromo-4-chloro-3-indolyl β-D-glucosaminide (CHEBI:75512) is a chloroindole (CHEBI:52508) 5-bromo-4-chloro-3-indolyl β-D-glucosaminide (CHEBI:75512) is a indolyl carbohydrate (CHEBI:24821) 5-bromo-4-chloro-3-indolyl β-D-glucosaminide (CHEBI:75512) is a monosaccharide derivative (CHEBI:63367) IUPAC Name 5-bromo-4-chloro-1H-indol-3-yl 2-amino-2-deoxy-β-D-glucopyranoside Synonym Source 5-bromo-4-chloroindoxyl β-D-glucosaminide ChEBI Last Modified 12 November 2015