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ONTOLOGY REPORT - ANNOTATIONS


Term:amaranthin
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Accession:CHEBI:2621 term browser browse the term
Definition:A disaccharide derivative that is betanidin in which a beta-D-glucuronosyl-(1->2)-beta-D-glucosyl moiety is attached at position 5.
Synonyms:exact_synonym: (1E,2S)-1-{(2E)-2-[(2S)-2,6-dicarboxy-2,3-dihydropyridin-4(1H)-ylidene]ethylidene}-5-[(beta-D-glucopyranosyluronic acid)-(1->2)-beta-D-glucopyranosyloxy]-6-hydroxy-2,3-dihydro-1H-indolium-2-carboxylate
 related_synonym: Amaranthin betacyanin;   Amarantin;   Formula=C30H34N2O19;   InChI=1S/C30H34N2O19/c33-8-17-18(35)20(37)24(51-29-22(39)19(36)21(38)23(50-29)28(46)47)30(49-17)48-16-6-10-5-14(27(44)45)32(13(10)7-15(16)34)2-1-9-3-11(25(40)41)31-12(4-9)26(42)43/h1-3,6-7,12,14,17-24,29-30,33,35-39H,4-5,8H2,(H5,34,40,41,42,43,44,45,46,47)/t12-,14-,17+,18+,19-,20-,21-,22+,23-,24+,29-,30+/m0/s1;   InChIKey=ATSKDYKYMQVTGH-POBNKHOBSA-N;   SMILES=OC[C@H]1O[C@@H](Oc2cc3C[C@@H](C([O-])=O)\\[N+](=C/C=C4\\C[C@H](NC(=C4)C(O)=O)C(O)=O)c3cc2O)[C@H](O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)[C@@H](O)[C@@H]1O;   betanidin 5-O-beta-[1''->2']-glucuronosyl-beta-glucoside;   betanidin 5-O-sophorobiuronic acid
 xref: CAS:15167-84-7 "ChemIDplus";   CAS:15167-84-7 "KEGG COMPOUND";   HMDB:HMDB0029406;   KEGG:C08537;   KNApSAcK:C00001581;   MetaCyc:CPD-8658;   Reaxys:8183321 "Reaxys"


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  CHEBI ontology 0
    role 0
      biological role 0
        biophysical role 0
          biological pigment 0
            amaranthin 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic group 0
                              organic divalent group 0
                                organodiyl group 0
                                  carbonyl group 0
                                    carbonyl compound 0
                                      carboxylic acid 0
                                        amino acid 0
                                          alpha-amino acid 0
                                            non-proteinogenic alpha-amino acid 0
                                              betanidin 0
                                                amaranthin 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.