EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:216473 - 5-O-methylnectriafurone

ChEBI IDCHEBI:216473
ChEBI Name5-O-methylnectriafurone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H14O7
Net Charge0
Average Mass318.281
Monoisotopic Mass318.07395
SMILESCOc1cc(OC)c2c(c1O)C(=O)c1c(coc1[C@H](C)O)C2=O
InChIInChI=1S/C16H14O7/c1-6(17)16-10-7(5-23-16)13(18)11-8(21-2)4-9(22-3)14(19)12(11)15(10)20/h4-6,17,19H,1-3H3/t6-/m0/s1
InChIKeyMZKMQTBWJGHUTB-LURJTMIESA-N
Species of MetaboliteComponentSourceComments
Clarireediaspecies CEC-2020a (ncbitaxon:2760841) - PubMed (30012966)
ChEBI Ontology
Outgoing Relation(s)
5-O-methylnectriafurone (CHEBI:216473) is a naphthofuran (CHEBI:39270)
IUPAC Name 
5-hydroxy-3-[(1S)-1-hydroxyethyl]-6,8-dimethoxybenzo[][2]benzouran-4,9-dione