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CHEBI:83337 - (S)-orciprenaline sulfate

ChEBI IDCHEBI:83337
ChEBI Name(S)-orciprenaline sulfate
Stars
ASCII Name(S)-orciprenaline sulfate
DefinitionAn alkylammonium sulfate obtained by combining (S)-orciprenaline and sulfuric acid in a 2:1 ratio.
Last Modified17 October 2014
SubmitterSteve
DownloadsMolfile
Formula2C11H17NO3.H2O4S
Net Charge0
Average Mass520.601
Monoisotopic Mass520.20907
SMILESCC(C)NC[C@@H](O)c1cc(O)cc(O)c1.CC(C)NC[C@@H](O)c1cc(O)cc(O)c1.O=S(=O)(O)O
InChIInChI=1S/2C11H17NO3.H2O4S/c2*1-7(2)12-6-11(15)8-3-9(13)5-10(14)4-8;1-5(2,3)4/h2*3-5,7,11-15H,6H2,1-2H3;(H2,1,2,3,4)/t2*11-;/m11./s1
InChIKeyMKFFGUZYVNDHIH-ZVRYYDNZSA-N
ChEBI Ontology
Outgoing Relation(s)
(S)-orciprenaline sulfate (CHEBI:83337) has part (S)-orciprenaline(1+) (CHEBI:83338)
(S)-orciprenaline sulfate (CHEBI:83337) is a alkylammonium sulfate (CHEBI:38015)
(S)-orciprenaline sulfate (CHEBI:83337) is enantiomer of (R)-orciprenaline sulfate (CHEBI:83333)
Incoming Relation(s)
(R)-orciprenaline sulfate (CHEBI:83333) is enantiomer of (S)-orciprenaline sulfate (CHEBI:83337)
IUPAC Names 
5-[(1S)-1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,3-diol sulfate (2:1)
bis{N-[(2S)-2-(3,5-dihydroxyphenyl)-2-hydroxyethyl]propan-2-aminium} sulfate