CHEBI:64062 - (R)-salmeterol

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ChEBI Name (R)-salmeterol
ChEBI ID CHEBI:64062
ChEBI ASCII Name (R)-salmeterol
Definition 2-(Hydroxymethyl)-4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)phenol in which the stereocentre has R configuration.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C25H37NO4
Net Charge 0
Average Mass 415.56560
Monoisotopic Mass 415.27226
InChI InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2/t25-/m0/s1
InChIKey GIIZNNXWQWCKIB-VWLOTQADSA-N
SMILES OCc1cc(ccc1O)[C@@H](O)CNCCCCCCOCCCCc1ccccc1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (R)-salmeterol (CHEBI:64062) is a 2-(hydroxymethyl)-4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)phenol (CHEBI:64064)
(R)-salmeterol (CHEBI:64062) is enantiomer of (S)-salmeterol (CHEBI:64063)
Incoming salmeterol (CHEBI:9011) has part (R)-salmeterol (CHEBI:64062)
(S)-salmeterol (CHEBI:64063) is enantiomer of (R)-salmeterol (CHEBI:64062)
Synonyms Sources
(R)-(−)-salmeterol ChEBI
(R)-4-(1-hydroxy-2-(6-(4-phenylbutoxy)hexylamino)ethyl)-2-(hydroxymethyl)phenol ChEBI
(R)-α-[((6-(4-phenylbutoxy)hexyl)amino)methy]-4-hydroxy-1,3-benzenedimethanol ChEBI
2-(hydroxymethyl)-4-((1R)-1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)phenol ChEBI
2-(hydroxymethyl)-4-[(1R)-1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl]phenol ChEBI
Registry Number Type Source
7082712 Reaxys Registry Number Reaxys
Last Modified
08 May 2014