EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:219055 - Asperorydine G

ChEBI IDCHEBI:219055
ChEBI NameAsperorydine G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20N2O4
Net Charge0
Average Mass352.390
Monoisotopic Mass352.14231
SMILESC[C@H](O)CC(=O)N1C(=O)c2c(cc3cccc4c3c2C(=O)N4C)C1(C)C
InChIInChI=1S/C20H20N2O4/c1-10(23)8-14(24)22-19(26)16-12(20(22,2)3)9-11-6-5-7-13-15(11)17(16)18(25)21(13)4/h5-7,9-10,23H,8H2,1-4H3/t10-/m0/s1
InChIKeyWQIRGFAZJZHHBZ-JTQLQIEISA-N
Species of MetaboliteComponentSourceComments
Aspergillus oryzae (ncbitaxon:5062) - PubMed (29271645)
ChEBI Ontology
Outgoing Relation(s)
Asperorydine G (CHEBI:219055) is a isoindoles (CHEBI:24897)
IUPAC Name 
4-(3-hydroxybutanoyl)-5,5,13-trimethyl-4,13-diazatetracyclo[6.6.1.02,6.012,15]pentadeca-1(15),2(6),7,9,11-pentaene-3,14-dione
Manual XrefsDatabases
78435289ChemSpider