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CHEBI:83329 - 5-[1-hydroxy-2-(isopropanylamino)ethyl]benzene-1,3-diol

Default Structure
ChEBI IDCHEBI:83329
ChEBI Name5-[1-hydroxy-2-(isopropanylamino)ethyl]benzene-1,3-diol
Stars
DefinitionA member of the class of resorcinols bearing an additional 1-hydroxy-2-(isopropanylamino)ethyl substituent at position 5 of resorcinol itself.
Last Modified25 February 2016
SubmitterSteve
DownloadsMolfile
FormulaC11H17NO3
Net Charge0
Average Mass211.261
Monoisotopic Mass211.12084
SMILESCC(C)NCC(O)c1cc(O)cc(O)c1
InChIInChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-9(13)5-10(14)4-8/h3-5,7,11-15H,6H2,1-2H3
InChIKeyLMOINURANNBYCM-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
5-[1-hydroxy-2-(isopropanylamino)ethyl]benzene-1,3-diol (CHEBI:83329) is a aralkylamino compound (CHEBI:64365)
5-[1-hydroxy-2-(isopropanylamino)ethyl]benzene-1,3-diol (CHEBI:83329) is a resorcinols (CHEBI:33572)
5-[1-hydroxy-2-(isopropanylamino)ethyl]benzene-1,3-diol (CHEBI:83329) is a secondary alcohol (CHEBI:35681)
5-[1-hydroxy-2-(isopropanylamino)ethyl]benzene-1,3-diol (CHEBI:83329) is a secondary amino compound (CHEBI:50995)
Incoming Relation(s)
(R)-orciprenaline (CHEBI:83330) is a 5-[1-hydroxy-2-(isopropanylamino)ethyl]benzene-1,3-diol (CHEBI:83329)
(S)-orciprenaline (CHEBI:83331) is a 5-[1-hydroxy-2-(isopropanylamino)ethyl]benzene-1,3-diol (CHEBI:83329)
IUPAC Name 
5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,3-diol