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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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Term Annotations click to browse term
  CHEBI ontology 2
    chemical entity 2
      molecular entity 2
        polyatomic entity 2
          molecule 2
            cyclic compound 2
              homocyclic compound 1
                carbocyclic compound 1
                  carbopolycyclic compound 0
                    carbotricyclic compound 0
                      anthracenes 0
                        anthraquinone 0
                          Dermocanarin 3 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 2
    subatomic particle 2
      composite particle 2
        hadron 2
          baryon 2
            nucleon 2
              atomic nucleus 2
                atom 2
                  main group element atom 2
                    p-block element atom 2
                      carbon group element atom 2
                        carbon atom 2
                          organic molecular entity 2
                            heteroorganic entity 2
                              organochalcogen compound 1
                                organooxygen compound 0
                                  carbonyl compound 0
                                    ketone 0
                                      cyclic ketone 0
                                        quinone 0
                                          acenoquinone 0
                                            anthraquinone 0
                                              Dermocanarin 3 0
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