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CHEBI:216906 - Microansamycin E

ChEBI IDCHEBI:216906
ChEBI NameMicroansamycin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H21NO5
Net Charge0
Average Mass319.357
Monoisotopic Mass319.14197
SMILESC[C@@H]1C(=O)Nc2cc(O)cc3c2O[C@H](C[C@@H](C)C1=O)[C@@H](O)CC3
InChIInChI=1S/C17H21NO5/c1-8-5-14-13(20)4-3-10-6-11(19)7-12(16(10)23-14)18-17(22)9(2)15(8)21/h6-9,13-14,19-20H,3-5H2,1-2H3,(H,18,22)/t8-,9+,13+,14-/m1/s1
InChIKeyKYQIWZZDXJQVAY-OBPYKSBLSA-N
Species of MetaboliteComponentSourceComments
Micromonosporaspecies (ncbitaxon:1876) - PubMed (29412682)
ChEBI Ontology
Outgoing Relation(s)
Microansamycin E (CHEBI:216906) is a aromatic ether (CHEBI:35618)
IUPAC Name 
(8S,9R,11R,13S)-3,8-dihydroxy-11,13-dimethyl-17-oxa-15-azatricyclo[7.6.2.05,16]heptadeca-1,3,5(16)-triene-12,14-dione
Manual XrefsDatabases
78439351ChemSpider