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Term:lactucopicrin 15-oxalate
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Accession:CHEBI:90280 term browser browse the term
Definition:A sesquiterpene lactone obtained by formal condensation of one of the carboxy groups of oxalic acid with the 15-hydroxy group of lactucopicrin. Found in chicory.
Synonyms:exact_synonym: {[(3aR,4S,9aS,9bR)-4-{[(4-hydroxyphenyl)acetyl]oxy}-6-methyl-3-methylidene-2,7-dioxo-2,3,3a,4,5,7,9a,9b-octahydroazuleno[4,5-b]furan-9-yl]methoxy}(oxo)acetic acid
 related_synonym: 15-oxalyllactucopicrin;   Formula=C25H22O10;   InChI=1S/C25H22O10/c1-11-7-17(34-18(28)8-13-3-5-15(26)6-4-13)20-12(2)24(31)35-22(20)21-14(9-16(27)19(11)21)10-33-25(32)23(29)30/h3-6,9,17,20-22,26H,2,7-8,10H2,1H3,(H,29,30)/t17-,20+,21-,22-/m0/s1;   InChIKey=AUULYUITRYGGJX-XGARDCMYSA-N;   SMILES=O(CC1=CC(=O)C2=C(C)C[C@@H]([C@]3(C(=C)C(=O)O[C@@]3([C@@]12[H])[H])[H])OC(=O)CC=4C=CC(O)=CC4)C(C(=O)O)=O
 xref: CAS:303130-75-8;   KNApSAcK:C00034018

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  CHEBI ontology 19790
    role 19738
      application 19385
        food additive 14705
          food acidity regulator 11597
            acetic acid 10705
              4-hydroxyphenylacetic acid 1
                lactucopicrin 15-oxalate 0
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  CHEBI ontology 19790
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19674
                    p-block element atom 19674
                      carbon group element atom 19572
                        carbon atom 19561
                          organic molecular entity 19561
                            organic group 18475
                              organic divalent group 18468
                                organodiyl group 18468
                                  carbonyl group 18366
                                    carbonyl compound 18366
                                      ketone 16011
                                        cyclic ketone 13487
                                          alicyclic ketone 1049
                                            cyclic terpene ketone 128
                                              lactucin 0
                                                lactucopicrin 15-oxalate 0
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