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ONTOLOGY REPORT - ANNOTATIONS


Term:dihydrobetulinic acid
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Accession:CHEBI:65485 term browser browse the term
Definition:A pentacyclic triterpenoid that is lupane having a 3beta-hydroxy and 28-carboxy substituents. Isolated from the leaves of Syzygium claviflorum, it exhibits anti-HIV and antileishmanial activity.
Synonyms:exact_synonym: (3beta)-3-hydroxylupan-28-oic acid
 related_synonym: 20,29-dihydrobetulinic acid;   Formula=C30H50O3;   InChI=1S/C30H50O3/c1-18(2)19-10-15-30(25(32)33)17-16-28(6)20(24(19)30)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h18-24,31H,8-17H2,1-7H3,(H,32,33)/t19-,20+,21-,22+,23-,24+,27-,28+,29+,30-/m0/s1;   InChIKey=PZXJOHSZQAEJFE-FZFNOLFKSA-N;   SMILES=[H][C@]12CC[C@]3([H])[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)CC[C@]1(CC[C@@H](C(C)C)[C@]21[H])C(O)=O
 xref: CAS:25488-53-3;   PMID:12765337;   PMID:8176401;   PMID:8676334;   PMID:9459011;   Patent:US5679828;   Reaxys:2678211


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  CHEBI ontology 21260
    role 21244
      biological role 21242
        biochemical role 20288
          metabolite 20227
            dihydrobetulinic acid 0
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  CHEBI ontology 21260
    subatomic particle 21256
      composite particle 21256
        hadron 21256
          baryon 21256
            nucleon 21256
              atomic nucleus 21256
                atom 21256
                  main group element atom 21125
                    p-block element atom 21125
                      carbon group element atom 20894
                        carbon atom 20785
                          organic molecular entity 20785
                            organic group 19179
                              organic divalent group 19169
                                organodiyl group 19169
                                  carbonyl group 19143
                                    carbonyl compound 19143
                                      carboxylic acid 18827
                                        hydroxy carboxylic acid 3725
                                          hydroxy monocarboxylic acid 3725
                                            dihydrobetulinic acid 0
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