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CHEBI:204234 - Yaequinolone F

ChEBI IDCHEBI:204234
ChEBI NameYaequinolone F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H31NO6
Net Charge0
Average Mass465.546
Monoisotopic Mass465.21514
SMILESC=C(C)C1CCC(C)(/C=C/c2ccc3c(c2O)[C@](O)(c2ccc(OC)cc2)[C@@H](OC)C(=O)N3)O1
InChIInChI=1S/C27H31NO6/c1-16(2)21-13-15-26(3,34-21)14-12-17-6-11-20-22(23(17)29)27(31,24(33-5)25(30)28-20)18-7-9-19(32-4)10-8-18/h6-12,14,21,24,29,31H,1,13,15H2,2-5H3,(H,28,30)/b14-12+/t21?,24-,26?,27+/m0/s1
InChIKeyBNZZZUQOYBAEPR-NWNQVQQSSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (17191680)
ChEBI Ontology
Outgoing Relation(s)
Yaequinolone F (CHEBI:204234) is a quinolines (CHEBI:26513)
IUPAC Name 
(3R,4R)-4,5-dihydroxy-3-methoxy-4-(4-methoxyphenyl)-6-[(E)-2-(2-methyl-5-prop-1-en-2-yloxolan-2-yl)ethenyl]-1,3-dihydroquinolin-2-one
Manual XrefsDatabases
17250054ChemSpider