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CHEBI:29700 - tylactone

ChEBI IDCHEBI:29700
ChEBI Nametylactone
Stars
DefinitionA 16-membererd macrolide that is the aglycone of the antibiotic 5-O-β-D-mycaminosyltylactone.
Secondary ChEBI IDCHEBI:76805
Last Modified13 June 2017
SubmitterKAX
DownloadsMolfile
FormulaC23H38O5
Net Charge0
Average Mass394.552
Monoisotopic Mass394.27192
SMILESCC[C@H]1C[C@@H](C)C(=O)/C=C/C(C)=C/[C@H](C)[C@@H](CC)OC(=O)C[C@@H](O)[C@H](C)[C@H]1O
InChIInChI=1S/C23H38O5/c1-7-18-12-15(4)19(24)10-9-14(3)11-16(5)21(8-2)28-22(26)13-20(25)17(6)23(18)27/h9-11,15-18,20-21,23,25,27H,7-8,12-13H2,1-6H3/b10-9+,14-11+/t15-,16+,17+,18+,20-,21-,23-/m1/s1
InChIKeyYJSXTLYNFBFHAT-HJOMEYPASA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
tylactone (CHEBI:29700) has role metabolite (CHEBI:25212)
tylactone (CHEBI:29700) is a diol (CHEBI:23824)
tylactone (CHEBI:29700) is a enone (CHEBI:51689)
tylactone (CHEBI:29700) is a macrolide (CHEBI:25106)
Incoming Relation(s)
20-oxo-5-O-β-mycaminosyltylactone (CHEBI:134191) has functional parent tylactone (CHEBI:29700)
5-O-mycaminosyltylonolide (CHEBI:77011) has functional parent tylactone (CHEBI:29700)
5-O-β-D-mycaminosyl-20-oxotylonolide (CHEBI:77009) has functional parent tylactone (CHEBI:29700)
5-O-β-D-mycaminosyltylactone (CHEBI:29491) has functional parent tylactone (CHEBI:29700)
demethyllactenocin (CHEBI:29572) has functional parent tylactone (CHEBI:29700)
demethylmacrocin (CHEBI:15906) has functional parent tylactone (CHEBI:29700)
macrocin (CHEBI:17371) has functional parent tylactone (CHEBI:29700)
tylosin (CHEBI:17658) has functional parent tylactone (CHEBI:29700)
IUPAC Name 
(4R,5S,6S,7S,9R,11E,13E,15S,16R)-7,16-diethyl-4,6-dihydroxy-5,9,13,15-tetramethyloxacyclohexadeca-11,13-diene-2,10-dione
Synonyms  Source
TylactoneKEGG COMPOUND
ProtylonolideKEGG COMPOUND
20-DsdrChemIDplus
20-Deoxo-12,13-desepoxy-12,13-dehydrorosaranolideChemIDplus
20-deoxo-23-deoxytylonolideChemIDplus
UniProt Name  Source
tylactoneUniProt
Manual XrefsDatabases
C12000KEGG COMPOUND
CPD-15948MetaCyc
Registry NumbersSources
Reaxys:5765520Reaxys
CAS:74758-60-4KEGG COMPOUND
CAS:74758-60-4ChemIDplus
Citations