EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:198566 - SF2809-II

ChEBI IDCHEBI:198566
ChEBI NameSF2809-II
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H27N3O4
Net Charge0
Average Mass481.552
Monoisotopic Mass481.20016
SMILESCC(=O)NCCc1c([C@@H](c2ccc(O)cc2)c2c(O)c3ccccc3n(C)c2=O)nc2ccccc12
InChIInChI=1S/C29H27N3O4/c1-17(33)30-16-15-21-20-7-3-5-9-23(20)31-27(21)25(18-11-13-19(34)14-12-18)26-28(35)22-8-4-6-10-24(22)32(2)29(26)36/h3-14,25,31,34-35H,15-16H2,1-2H3,(H,30,33)/t25-/m0/s1
InChIKeyIGHADMRZFBJJIK-VWLOTQADSA-N
Species of MetaboliteComponentSourceComments
Dactylosporangium (ncbitaxon:35753) - PubMed (15112956)
ChEBI Ontology
Outgoing Relation(s)
SF2809-II (CHEBI:198566) is a hydroxyquinoline (CHEBI:38774)
IUPAC Name 
N-[2-[2-[(4-hydroxy-1-methyl-2-oxoquinolin-3-yl)-(4-hydroxyphenyl)methyl]-1H-indol-3-yl]ethyl]acetamide
Manual XrefsDatabases
19059362ChemSpider