CHEBI:87725 - (R)-prasugrel

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ChEBI Name (R)-prasugrel
ChEBI ID CHEBI:87725
ChEBI ASCII Name (R)-prasugrel
Definition An 5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate that is the (R)-enantiomer of prasugrel (the racemate is a cardiovascular drug).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H20FNO3S
Net Charge 0
Average Mass 373.443
Monoisotopic Mass 373.11479
InChI InChI=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/t19-/m1/s1
InChIKey DTGLZDAWLRGWQN-LJQANCHMSA-N
SMILES N1(CCC2=C(C1)C=C(S2)OC(C)=O)[C@H](C3=C(C=CC=C3)F)C(=O)C4CC4
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)-prasugrel (CHEBI:87725) is a 5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate (CHEBI:87723)
(R)-prasugrel (CHEBI:87725) is conjugate base of (R)-prasugrel(1+) (CHEBI:87727)
(R)-prasugrel (CHEBI:87725) is enantiomer of (S)-prasugrel (CHEBI:87724)
Incoming prasugrel (CHEBI:87715) has part (R)-prasugrel (CHEBI:87725)
(R)-prasugrel(1+) (CHEBI:87727) is conjugate acid of (R)-prasugrel (CHEBI:87725)
(S)-prasugrel (CHEBI:87724) is enantiomer of (R)-prasugrel (CHEBI:87725)
IUPAC Name
5-[(1R)-2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate
Last Modified
22 October 2015