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CHEBI:218140 - Flavichalasine O

ChEBI IDCHEBI:218140
ChEBI NameFlavichalasine O
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H36N2O5
Net Charge0
Average Mass420.550
Monoisotopic Mass420.26242
SMILESCC1=C[C@@H]2/C=C(\C)CC[C@@H](O)C(=O)[C@@H](O)CNO[C@]23C(=O)N[C@@H](CC(C)C)[C@@H]3[C@@H]1C
InChIInChI=1S/C23H36N2O5/c1-12(2)8-17-20-15(5)14(4)10-16-9-13(3)6-7-18(26)21(28)19(27)11-24-30-23(16,20)22(29)25-17/h9-10,12,15-20,24,26-27H,6-8,11H2,1-5H3,(H,25,29)/b13-9+/t15-,16+,17+,18-,19+,20+,23-/m1/s1
InChIKeyQFHWHVFDKVHHFV-JTAGQVBZSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.tetlet.2018.03.077)
ChEBI Ontology
Outgoing Relation(s)
Flavichalasine O (CHEBI:218140) is a isoindoles (CHEBI:24897)
IUPAC Name 
(1R,5S,7R,10E,12S,15S,16S,17S)-5,7-dihydroxy-10,14,15-trimethyl-17-(2-methylpropyl)-2-oxa-3,18-diazatricyclo[10.7.0.01,16]nonadeca-10,13-diene-6,19-dione
Manual XrefsDatabases
65329848ChemSpider