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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:Dermocanarin 3
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Accession:CHEBI:199838 term browser browse the term
Synonyms:exact_synonym: 10-(13,21-dihydroxy-5,7,29-trimethoxy-13,23-dimethyl-3,15,19,26-tetraoxo-16-oxahexacyclo[15.12.0.02,11.04,9.018,27.020,25]nonacosa-1(29),2(11),4(9),5,7,17,20(25),21,23,27-decaen-10-yl)-13,21-dihydroxy-5,7,29-trimethoxy-13,23-dimethyl-16-oxahexacyclo[15.12.0.02,11.04,9.018,27.020,25]nonacosa-1(29),2(11),4(9),5,7,17,20(25),21,23,27-decaene-3,15,19,26-tetrone
 related_synonym: Formula=C66H54O20;   InChI=1S/C66H54O20/c1-25-11-31-47(37(67)13-25)59(73)53-33(57(31)71)19-41(83-9)55-51-35(21-65(3,77)23-43(69)85-63(53)55)45(29-15-27(79-5)17-39(81-7)49(29)61(51)75)46-30-16-28(80-6)18-40(82-8)50(30)62(76)52-36(46)22-66(4,78)24-44(70)86-64-54-34(20-42(84-10)56(52)64)58(72)32-12-26(2)14-38(68)48(32)60(54)74/h11-20,45-46,67-68,77-78H,21-24H2,1-10H3;   InChIKey=XSMJOWAYUATXHH-UHFFFAOYSA-N;   SMILES=O=C1OC2=C(C=3C(=O)C=4C(OC)=CC(=CC4C(C3CC(C1)(O)C)C5C6=C(C(=O)C7=C5CC(O)(CC(=O)OC8=C7C(OC)=CC9=C8C(=O)C%10=C(O)C=C(C)C=C%10C9=O)C)C(OC)=CC(=C6)OC)OC)C(OC)=CC%11=C2C(=O)C%12=C(O)C=C(C)C=C%12C%11=O
 xref: Chemspider:17298975


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Path 1
Term Annotations click to browse term
  CHEBI ontology 26489
    chemical entity 26469
      molecular entity 26451
        polyatomic entity 26276
          molecule 25390
            cyclic compound 24402
              homocyclic compound 22136
                carbocyclic compound 22146
                  carbopolycyclic compound 19858
                    carbotricyclic compound 1599
                      anthracenes 605
                        anthraquinone 537
                          Dermocanarin 3 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26489
    subatomic particle 26465
      composite particle 26457
        hadron 26457
          baryon 26465
            nucleon 26457
              atomic nucleus 26465
                atom 26457
                  main group element atom 26200
                    p-block element atom 26192
                      carbon group element atom 25635
                        carbon atom 25598
                          organic molecular entity 25598
                            heteroorganic entity 25001
                              organochalcogen compound 24596
                                organooxygen compound 24191
                                  carbonyl compound 23659
                                    ketone 19583
                                      cyclic ketone 17232
                                        quinone 10689
                                          acenoquinone 8217
                                            anthraquinone 537
                                              Dermocanarin 3 0
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