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CHEBI:206074 - Amicoumacin C

ChEBI IDCHEBI:206074
ChEBI NameAmicoumacin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26N2O7
Net Charge0
Average Mass406.435
Monoisotopic Mass406.17400
SMILESCC(C)CC(NC(=O)C(O)C1OC(=O)CC1N)C1Cc2cccc(O)c2C(=O)O1
InChIInChI=1S/C20H26N2O7/c1-9(2)6-12(22-19(26)17(25)18-11(21)8-15(24)29-18)14-7-10-4-3-5-13(23)16(10)20(27)28-14/h3-5,9,11-12,14,17-18,23,25H,6-8,21H2,1-2H3,(H,22,26)
InChIKeyHVZSDRPOEPOHHS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bacillus (ncbitaxon:1386) - DOI (10.1271/bbb1961.46.2659)
ChEBI Ontology
Outgoing Relation(s)
Amicoumacin C (CHEBI:206074) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
2-(3-amino-5-oxooxolan-2-yl)-2-hydroxy-N-[1-(8-hydroxy-1-oxo-3,4-dihydroisochromen-3-yl)-3-methylbutyl]acetamide
Manual XrefsDatabases
23126111ChemSpider