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CHEBI:87726 - (S)-prasugrel(1+)

ChEBI IDCHEBI:87726
ChEBI Name(S)-prasugrel(1+)
Stars
ASCII Name(S)-prasugrel(1+)
DefinitionAn organic cation resulting from the protonation of the amino group of (S)-prasugrel.
Last Modified27 August 2015
SubmitterSteve
DownloadsMolfile
FormulaC20H21FNO3S
Net Charge+1
Average Mass374.457
Monoisotopic Mass374.12207
SMILESCC(=O)Oc1cc2c(s1)CC[NH+]([C@H](C(=O)C1CC1)c1ccccc1F)C2
InChIInChI=1S/C20H20FNO3S/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/p+1/t19-/m0/s1
InChIKeyDTGLZDAWLRGWQN-IBGZPJMESA-O
ChEBI Ontology
Outgoing Relation(s)
(S)-prasugrel(1+) (CHEBI:87726) is a ammonium ion derivative (CHEBI:35274)
(S)-prasugrel(1+) (CHEBI:87726) is a organic cation (CHEBI:25697)
(S)-prasugrel(1+) (CHEBI:87726) is conjugate acid of (S)-prasugrel (CHEBI:87724)
(S)-prasugrel(1+) (CHEBI:87726) is enantiomer of (R)-prasugrel(1+) (CHEBI:87727)
Incoming Relation(s)
(S)-prasugrel hydrochloride (CHEBI:87708) has part (S)-prasugrel(1+) (CHEBI:87726)
(S)-prasugrel (CHEBI:87724) is conjugate base of (S)-prasugrel(1+) (CHEBI:87726)
(R)-prasugrel(1+) (CHEBI:87727) is enantiomer of (S)-prasugrel(1+) (CHEBI:87726)
IUPAC Name 
2-(acetyloxy)-5-[(1S)-2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium