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CHEBI:198977 - Nodulisporin D

ChEBI IDCHEBI:198977
ChEBI NameNodulisporin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H20O4
Net Charge0
Average Mass336.387
Monoisotopic Mass336.13616
SMILESCOc1cccc2c(C3C[C@H](C)Oc4cccc(O)c43)ccc(O)c12
InChIInChI=1S/C21H20O4/c1-12-11-15(21-16(22)6-4-8-19(21)25-12)13-9-10-17(23)20-14(13)5-3-7-18(20)24-2/h3-10,12,15,22-23H,11H2,1-2H3/t12-,15?/m0/s1
InChIKeyDKRYQWDVVHWFJF-SFVWDYPZSA-N
Species of MetaboliteComponentSourceComments
Nodulisporiumspecies (ncbitaxon:1897413) - DOI (10.1002/ejoc.200801106)
ChEBI Ontology
Outgoing Relation(s)
Nodulisporin D (CHEBI:198977) is a naphthols (CHEBI:25392)
IUPAC Name 
(2S)-4-(4-hydroxy-5-methoxynaphthalen-1-yl)-2-methyl-3,4-dihydro-2H-chromen-5-ol
Manual XrefsDatabases
78436437ChemSpider