Send us a Message



Submit Data |  Help |  Video Tutorials |  News |  Publications |  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:cassiaoccidentalin A
go back to main search page
Accession:CHEBI:140126 term browser browse the term
Synonyms:related_synonym: Formula=C27H28O13;   InChI=1S/C27H28O13/c1-9-20(32)23(35)26(40-27-24(36)22(34)19(31)10(2)38-27)25(37-9)18-14(30)8-16-17(21(18)33)13(29)7-15(39-16)11-3-5-12(28)6-4-11/h3-10,19-20,22,24-28,30-34,36H,1-2H3/t9?,10?,19-,20+,22-,24?,25-,26-,27-/m0/s1;   InChIKey=KCQFNIYRJNSNLG-DVHOVLSXSA-N;   SMILES=C=1(OC2=C(C(C1)=O)C(=C(C(=C2)O)[C@H]3[C@H](C([C@@H](C(O3)C)O)=O)O[C@H]4C([C@H]([C@H](C(O4)C)O)O)O)O)C5=CC=C(C=C5)O
 xref: LIPID_MAPS_instance:LMPK12110268


show annotations for term's descendants           Sort by:
 

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 24518
    chemical entity 24486
      atom 24476
        nonmetal atom 24194
          oxygen atom 23283
            oxygen molecular entity 23283
              flavonoids 11170
                flavonoid 6932
                  flavones 4353
                    cassiaoccidentalin A 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 24518
    subatomic particle 24476
      composite particle 24476
        hadron 24476
          baryon 24476
            nucleon 24476
              atomic nucleus 24476
                atom 24476
                  main group element atom 24334
                    p-block element atom 24334
                      carbon group element atom 24120
                        carbon atom 24082
                          organic molecular entity 24082
                            organic molecule 23963
                              organic cyclic compound 23166
                                organic heterocyclic compound 21325
                                  oxacycle 19578
                                    benzopyran 10774
                                      1-benzopyran 10477
                                        flavonoid 6932
                                          flavones 4353
                                            cassiaoccidentalin A 0
paths to the root