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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:hematoporphyrin
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Accession:CHEBI:36162 term browser browse the term
Definition:A dicarboxylic acid that is protoporphyrin in which the vinyl groups at positions 7 and 12 are replaced by 1-hydroxyethyl groups.
Synonyms:exact_synonym: 7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethylporphyrin-2,18-dipropanoic acid
 related_synonym: 7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoic acid;   Formula=C34H38N4O6;   Haematoporphyrin;   InChI=1S/C34H38N4O6/c1-15-21(7-9-31(41)42)27-14-28-22(8-10-32(43)44)16(2)24(36-28)12-29-34(20(6)40)18(4)26(38-29)13-30-33(19(5)39)17(3)25(37-30)11-23(15)35-27/h11-14,19-20,36-37,39-40H,7-10H2,1-6H3,(H,41,42)(H,43,44)/b23-11-,24-12-,25-11-,26-13-,27-14-,28-14-,29-12-,30-13-;   InChIKey=UJKPHYRXOLRVJJ-AMPAVEGJSA-N;   SMILES=CC(O)c1c(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CCC(O)=O)c(CCC(O)=O)c4C)c(C)c3C(C)O;   hematoporphyrin IX
 xref: Beilstein:604648;   CAS:14459-29-1;   Drug_Central:3274;   Gmelin:423149;   PMID:15581389;   PMID:17993275;   PMID:19560444;   PMID:21282440;   PMID:21314289;   PMID:21315138;   PMID:21447321;   PMID:21702446;   PMID:21725592;   PMID:21769362;   Reaxys:1208096;   Reaxys:78957


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Term Annotations click to browse term
  CHEBI ontology 19874
    role 19844
      biological role 19842
        biochemical role 19549
          metabolite 19537
            protoporphyrin 25
              hematoporphyrin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19874
    subatomic particle 19872
      composite particle 19872
        hadron 19872
          baryon 19872
            nucleon 19872
              atomic nucleus 19872
                atom 19872
                  main group element atom 19811
                    p-block element atom 19811
                      carbon group element atom 19751
                        carbon atom 19748
                          organic molecular entity 19748
                            organic molecule 19700
                              organic cyclic compound 19490
                                organic heterocyclic compound 18868
                                  organonitrogen heterocyclic compound 18148
                                    polypyrrole 698
                                      tetrapyrrole 585
                                        cyclic tetrapyrrole 456
                                          porphyrins 372
                                            protoporphyrins 345
                                              protoporphyrin 25
                                                hematoporphyrin 0
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