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ONTOLOGY REPORT - ANNOTATIONS


Term:erythromycin estolate
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Accession:CHEBI:4846 term browser browse the term
Definition:An erythromycin derivative that has formula C40H71NO14.C12H26O4S.
Synonyms:exact_synonym: (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-(2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranosyloxy)-14-ethyl-7,12,13-trihydroxy-6-[3,4,6-trideoxy-3-(dimethylamino)-2-O-propanoyl-beta-D-xylo-hexopyranosyloxy]-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione dodecyl hydrogen sulfate
 related_synonym: Eriscel;   Eritroger;   Eromycin;   Erythromycin estorate;   Estomicina;   Formula=C40H71NO14.C12H26O4S;   Ilosone;   InChI=1S/C40H71NO14.C12H26O4S/c1-15-27-40(11,48)33(44)22(5)30(43)20(3)18-38(9,47)35(55-37-32(53-28(42)16-2)26(41(12)13)17-21(4)50-37)23(6)31(24(7)36(46)52-27)54-29-19-39(10,49-14)34(45)25(8)51-29;1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h20-27,29,31-35,37,44-45,47-48H,15-19H2,1-14H3;2-12H2,1H3,(H,13,14,15)/t20-,21-,22+,23+,24-,25+,26+,27-,29+,31+,32-,33-,34+,35-,37+,38-,39-,40-;/m1./s1;   InChIKey=AWMFUEJKWXESNL-JZBHMOKNSA-N;   Lauromicina;   Marcoeritrex;   Neo-erycinum;   PELS;   Roxomicina;   SMILES=CCCCCCCCCCCCOS(O)(=O)=O.CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2OC(=O)CC)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O;   Stellamicina;   erythromycin 2'-propionate dodecyl sulfate (salt);   erythromycin propionate, compound with dodecyl sulfate;   lauryl sulfate propionyl erythromycin ester;   monopropionylerythromycin laurylsulfate;   propionic acid, 2'-ester with erythromycin, dodecyl sulfate;   propionylerythromycin lauryl sulfate
 xref: Beilstein:3897327 "Beilstein";   CAS:3521-62-8 "ChemIDplus";   CAS:3521-62-8 "KEGG COMPOUND";   KEGG:C08031;   KEGG:D00851;   LIPID_MAPS_instance:LMPK04000015 "LIPID MAPS"
 xref_mesh: MESH:D004918
 xref: Patent:US3000874


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  CHEBI ontology 0
    role 0
      biological role 0
        inhibitor 0
          enzyme inhibitor 0
            erythromycin estolate 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic group 0
                              organic divalent group 0
                                organodiyl group 0
                                  carbonyl group 0
                                    carbonyl compound 0
                                      carboxylic ester 0
                                        lactone 0
                                          macrocyclic lactone 0
                                            macrolide 0
                                              erythronolide 0
                                                erythromycins 0
                                                  erythromycin 0
                                                    erythromycin A 0
                                                      erythromycin A 2'-propanoate 0
                                                        erythromycin estolate 0
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