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

ONTOLOGY REPORT - ANNOTATIONS


Term:hapten OTAd
go back to main search page
Accession:CHEBI:141313 term browser browse the term
Definition:A synthetic phenylalanine derivative derived formally from the mycotoxin ochratoxin A by replacement of the methyl group at position 3 of the isochromene ring with a 4-carboxybutyl group.
Synonyms:exact_synonym: 5-(7-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-5-chloro-8-hydroxy-1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl)pentanoic acid
 related_synonym: 5-(7-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-5-chloro-8-hydroxy-1-oxo-3,4-dihydro-1H-isochromen-3-yl)pentanoic acid;   Formula=C24H24ClNO8;   InChI=1S/C24H24ClNO8/c25-17-12-16(22(30)26-18(23(31)32)10-13-6-2-1-3-7-13)21(29)20-15(17)11-14(34-24(20)33)8-4-5-9-19(27)28/h1-3,6-7,12,14,18,29H,4-5,8-11H2,(H,26,30)(H,27,28)(H,31,32)/t14?,18-/m0/s1;   InChIKey=FTWYAEHEAFBKQR-IBYPIGCZSA-N;   N-[[3-(4-carboxybutyl)-5-chloro-3,4-dihydro-8-hydroxy-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-L-phenylalanine;   SMILES=C1=CC=CC=C1C[C@@H](C(=O)O)NC(=O)C2=CC(=C3C(=C2O)C(OC(C3)CCCCC(=O)O)=O)Cl
 xref: PMID:29950703 "Europe PMC"


show annotations for term's descendants       view all columns           Sort by:
 

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19657
    role 19601
      biological role 19599
        hapten 2964
          hapten OTAd 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19657
    subatomic particle 19653
      composite particle 19653
        hadron 19653
          baryon 19653
            nucleon 19653
              atomic nucleus 19653
                atom 19653
                  main group element atom 19534
                    main group molecular entity 19534
                      s-block molecular entity 19319
                        hydrogen molecular entity 19310
                          hydrides 18237
                            organic hydride 17526
                              organic fundamental parent 17526
                                hydrocarbon 16933
                                  cyclic hydrocarbon 15093
                                    monocyclic hydrocarbon 5628
                                      annulene 5444
                                        aromatic annulene 5444
                                          benzene 5444
                                            alkylbenzene 3187
                                              methylbenzene 3049
                                                toluene 2910
                                                  benzyl group 2352
                                                    phenylalanine 2352
                                                      L-phenylalanine 2097
                                                        L-phenylalanine derivative 2086
                                                          N-acyl-L-phenylalanine 1243
                                                            ochratoxin A 1243
                                                              hapten OTAd 0
paths to the root

NHLBI Logo

RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.