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CHEBI:222762 - Chaetoglobinol A

ChEBI IDCHEBI:222762
ChEBI NameChaetoglobinol A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H30N2O5
Net Charge0
Average Mass522.601
Monoisotopic Mass522.21547
SMILESCC(C)=CCc1ccc2ncc(C3=C(O)C(=O)[C@](O)(c4cnc5ccc(CC=C(C)C)cc45)C(=O)C3=O)c2c1
InChIInChI=1S/C32H30N2O5/c1-17(2)5-7-19-9-11-25-21(13-19)23(15-33-25)27-28(35)30(37)32(39,31(38)29(27)36)24-16-34-26-12-10-20(14-22(24)26)8-6-18(3)4/h5-6,9-16,33-35,39H,7-8H2,1-4H3/t32-/m1/s1
InChIKeyQOAPGRJTTCYFMV-JGCGQSQUSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033) - PubMed (26125976)
ChEBI Ontology
Outgoing Relation(s)
Chaetoglobinol A (CHEBI:222762) is a indoles (CHEBI:24828)
IUPAC Name 
3,5-dihydroxy-3,6-bis[5-(3-methylbut-2-enyl)-1H-indol-3-yl]cyclohex-5-ene-1,2,4-trione
Manual XrefsDatabases
59000440ChemSpider