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CHEBI:216920 - Microansamycin G

ChEBI IDCHEBI:216920
ChEBI NameMicroansamycin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23NO6
Net Charge0
Average Mass349.383
Monoisotopic Mass349.15254
SMILESCCC(=O)C(C)=C[C@H]1Oc2c(cc(O)cc2NC(=O)CO)CC[C@@H]1O
InChIInChI=1S/C18H23NO6/c1-3-14(22)10(2)6-16-15(23)5-4-11-7-12(21)8-13(18(11)25-16)19-17(24)9-20/h6-8,15-16,20-21,23H,3-5,9H2,1-2H3,(H,19,24)/t15-,16+/m0/s1
InChIKeyCYYOWCJHSDSDCW-JKSUJKDBSA-N
Species of MetaboliteComponentSourceComments
Micromonosporaspecies (ncbitaxon:1876) - PubMed (29412682)
ChEBI Ontology
Outgoing Relation(s)
Microansamycin G (CHEBI:216920) is a oxacycle (CHEBI:38104)
IUPAC Name 
N-[(2R,3S)-3,7-dihydroxy-2-(2-methyl-3-oxopent-1-enyl)-2,3,4,5-tetrahydro-1-benzoxepin-9-yl]-2-hydroxyacetamide
Manual XrefsDatabases
78439353ChemSpider