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ONTOLOGY REPORT - ANNOTATIONS


Term:2-hydroxyrubiarbonone E
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Accession:CHEBI:69506 term browser browse the term
Definition:A pentacyclic triterpenoid of the class of arborinane-type terpenoids isolated from the roots of Rubia yunnanensis.
Synonyms:exact_synonym: (1R,3S,3aR,5aS,5bS,6S,7aR,11aR,13aR,13bR)-1,6,10-trihydroxy-3a-(hydroxymethyl)-5a,8,8,11a,13a-pentamethyl-3-(propan-2-yl)-1,2,3,3a,4,5,5a,5b,6,7,7a,8,11a,13,13a,13b-hexadecahydro-9H-cyclopenta[a]chrysen-9-one
 related_synonym: 2,7beta,19alpha,28-tetrahydroxyarbor-1,9(11)-dien-3-one;   Formula=C30H46O5;   InChI=1S/C30H46O5/c1-16(2)18-12-20(33)24-29(7)9-8-17-23(28(29,6)10-11-30(18,24)15-31)19(32)13-22-26(3,4)25(35)21(34)14-27(17,22)5/h8,14,16,18-20,22-24,31-34H,9-13,15H2,1-7H3/t18-,19-,20+,22-,23-,24+,27+,28-,29+,30+/m0/s1;   InChIKey=UHUNEDUYMMOJKF-MGCRBRERSA-N;   SMILES=CC(C)[C@@H]1C[C@@H](O)[C@H]2[C@@]1(CO)CC[C@@]1(C)[C@@H]3[C@@H](O)C[C@H]4C(C)(C)C(=O)C(O)=C[C@]4(C)C3=CC[C@]21C
 xref: PMID:21973054;   Reaxys:22020817


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Term Annotations click to browse term
  CHEBI ontology 24141
    role 24034
      biological role 24000
        biochemical role 23264
          metabolite 23166
            2-hydroxyrubiarbonone E 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 24141
    subatomic particle 24095
      composite particle 24095
        hadron 24095
          baryon 24095
            nucleon 24095
              atomic nucleus 24095
                atom 24095
                  main group element atom 23924
                    p-block element atom 23924
                      carbon group element atom 23656
                        carbon atom 23612
                          organic molecular entity 23612
                            organic group 22086
                              organic divalent group 22060
                                organodiyl group 22060
                                  carbonyl group 22035
                                    carbonyl compound 22035
                                      ketone 18148
                                        cyclic ketone 14547
                                          alicyclic ketone 1048
                                            cyclic terpene ketone 132
                                              2-hydroxyrubiarbonone E 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.