EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:87714 - (R)-prasugrel hydrochloride

ChEBI IDCHEBI:87714
ChEBI Name(R)-prasugrel hydrochloride
Stars
ASCII Name(R)-prasugrel hydrochloride
DefinitionA hydrochloride obtained by reaction of (R)-prasugrel with one equivalent of hydrochloric acid (the racemic salt is a cardiovascular drug).
Last Modified27 August 2015
SubmitterSteve
DownloadsMolfile
FormulaC20H20FNO3S.HCl
Net Charge0
Average Mass409.910
Monoisotopic Mass409.09147
SMILESCC(=O)Oc1cc2c(s1)CCN([C@@H](C(=O)C1CC1)c1ccccc1F)C2.Cl
InChIInChI=1S/C20H20FNO3S.ClH/c1-12(23)25-18-10-14-11-22(9-8-17(14)26-18)19(20(24)13-6-7-13)15-4-2-3-5-16(15)21;/h2-5,10,13,19H,6-9,11H2,1H3;1H/t19-;/m1./s1
InChIKeyJALHGCPDPSNJNY-FSRHSHDFSA-N
ChEBI Ontology
Outgoing Relation(s)
(R)-prasugrel hydrochloride (CHEBI:87714) has part (R)-prasugrel(1+) (CHEBI:87727)
(R)-prasugrel hydrochloride (CHEBI:87714) is a hydrochloride (CHEBI:36807)
(R)-prasugrel hydrochloride (CHEBI:87714) is enantiomer of (S)-prasugrel hydrochloride (CHEBI:87708)
Incoming Relation(s)
prasugrel hydrochloride (CHEBI:87697) has part (R)-prasugrel hydrochloride (CHEBI:87714)
(S)-prasugrel hydrochloride (CHEBI:87708) is enantiomer of (R)-prasugrel hydrochloride (CHEBI:87714)
IUPAC Names 
5-[(1R)-2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate hydrochloride
2-(acetyloxy)-5-[(1R)-2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium chloride