Submit Data |  Help |  Video Tutorials |  News |  Publications |  FTP Download |  REST API |  Citing RGD |  Contact   

CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:(S)-prasugrel hydrochloride
go back to main search page
Accession:CHEBI:87708 term browser browse the term
Definition:A hydrochloride obtained by reaction of (S)-prasugrel with one equivalent of hydrochloric acid (the racemic salt is a cardiovascular drug).
Synonyms:exact_synonym: 2-(acetyloxy)-5-[(1S)-2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-ium chloride;   5-[(1S)-2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate hydrochloride
 related_synonym: Formula=C20H21ClFNO3S;   InChI=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-;/m0./s1;   InChIKey=JALHGCPDPSNJNY-FYZYNONXSA-N;   SMILES=Cl.N1(CCC2=C(C1)C=C(S2)OC(C)=O)[C@@H](C3=C(C=CC=C3)F)C(=O)C4CC4
 cyclic_relationship: is_enantiomer_of CHEBI:87714


show annotations for term's descendants           Sort by:
 

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 874
    chemical entity 874
      molecular entity 872
        ion 131
          organic ion 57
            organic cation 38
              (S)-prasugrel(1+) 0
                (S)-prasugrel hydrochloride 0
                  prasugrel hydrochloride 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 874
    subatomic particle 859
      composite particle 859
        hadron 859
          baryon 859
            nucleon 859
              atomic nucleus 859
                atom 859
                  main group element atom 849
                    p-block element atom 846
                      halogen 283
                        chlorine atom 236
                          chlorine molecular entity 236
                            elemental chlorine 26
                              monoatomic chlorine 12
                                chloride 12
                                  chloride salt 12
                                    organic chloride salt 5
                                      hydrochloride 5
                                        (S)-prasugrel hydrochloride 0
                                          prasugrel hydrochloride 0
paths to the root