Submit Data |  Help |  Video Tutorials |  News |  Publications |  FTP Download |  REST API |  Citing RGD |  Contact   

ONTOLOGY REPORT - ANNOTATIONS


Term:4'-O-demethylsordarin
go back to main search page
Accession:CHEBI:140297 term browser browse the term
Definition:A tetracyclic diterpenoid consisting of sordaricin in which the primary hydroxy hydrogen has been replaced by a 6-deoxy-beta-D-altropyranosyl group.
Synonyms:exact_synonym: (1R,3aR,4S,4aR,7R,7aR,8aS)-8a-{[(6-deoxy-beta-D-altropyranosyl)oxy]methyl}-4-formyl-7-methyl-3-(propan-2-yl)-4,4a,5,6,7,7a,8,8a-octahydro-1,4-methano-s-indacene-3a(1H)-carboxylic acid
 related_synonym: 4'-Demethylsordarin;   4'-O-demethyl sordarin;   Formula=C26H38O8;   InChI=1S/C26H38O8/c1-12(2)18-7-15-8-24(10-27)17-6-5-13(3)16(17)9-25(15,26(18,24)23(31)32)11-33-22-21(30)20(29)19(28)14(4)34-22/h7,10,12-17,19-22,28-30H,5-6,8-9,11H2,1-4H3,(H,31,32)/t13-,14-,15-,16-,17-,19-,20-,21+,22-,24+,25+,26+/m1/s1;   InChIKey=YTWDSZAPPKUSFS-OIAXQXJYSA-N;   SMILES=[C@@]12([C@]3([C@](C[C@@]1([C@]4([H])CC[C@H]([C@]4(C3)[H])C)C=O)(C=C2C(C)C)[H])CO[C@]5([C@H]([C@@H]([C@@H]([C@H](O5)C)O)O)O)[H])C(O)=O
 xref: CAS:178970-49-5 "KNApSAcK";   KNApSAcK:C00015132;   MetaCyc:CPD-20459;   PMID:19249360 "Europe PMC";   PMID:27072286 "Europe PMC";   Reaxys:25336129 "Reaxys"
 cyclic_relationship: is_conjugate_acid_of CHEBI:140233


show annotations for term's descendants       view all columns           Sort by:
 

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19716
    role 19663
      application 19308
        solvent 16081
          formic acid 7759
            formyl group 7725
              aldehyde 7725
                4'-O-demethylsordarin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19716
    subatomic particle 19712
      composite particle 19712
        hadron 19712
          baryon 19712
            nucleon 19712
              atomic nucleus 19712
                atom 19712
                  main group element atom 19598
                    p-block element atom 19598
                      carbon group element atom 19486
                        carbon atom 19480
                          organic molecular entity 19480
                            organic group 18407
                              organic divalent group 18397
                                organodiyl group 18397
                                  carbonyl group 18285
                                    carbonyl compound 18285
                                      carboxylic acid 17940
                                        carboacyl group 16948
                                          univalent carboacyl group 16948
                                            formyl group 7725
                                              aldehyde 7725
                                                4'-O-demethylsordarin 0
paths to the root

NHLBI Logo

RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.