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CHEBI:200808 - Cochliomycin A

ChEBI IDCHEBI:200808
ChEBI NameCochliomycin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H28O7
Net Charge0
Average Mass404.459
Monoisotopic Mass404.18350
SMILESCOc1cc(O)c2c(c1)/C=C/C[C@H](O)[C@@H]1OC(C)(C)O[C@H]1C=CC[C@H](C)OC2=O
InChIInChI=1S/C22H28O7/c1-13-7-5-10-18-20(29-22(2,3)28-18)16(23)9-6-8-14-11-15(26-4)12-17(24)19(14)21(25)27-13/h5-6,8,10-13,16,18,20,23-24H,7,9H2,1-4H3/b8-6+,10-5?/t13-,16-,18-,20-/m0/s1
InChIKeyJMSMAQNHTBWNAJ-XVIFUSKMSA-N
Species of MetaboliteComponentSourceComments
Curvularia lunata (ncbitaxon:5503) - PubMed (21348465)
ChEBI Ontology
Outgoing Relation(s)
Cochliomycin A (CHEBI:200808) is a macrolide (CHEBI:25106)
IUPAC Name 
(2E,5S,6S,10S,14S)-5,18-dihydroxy-20-methoxy-8,8,14-trimethyl-7,9,15-trioxatricyclo[15.4.0.06,10]henicosa-1(17),2,11,18,20-pentaen-16-one