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CHEBI:226571 - Nigcollin C

ChEBI IDCHEBI:226571
ChEBI NameNigcollin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O6
Net Charge0
Average Mass296.319
Monoisotopic Mass296.12599
SMILESCC(O)C(O)C=C[C@@H]1CC2=CC(=O)[C@@](C)(O)[C@@H](O)C2=CO1
InChIInChI=1S/C15H20O6/c1-8(16)12(17)4-3-10-5-9-6-13(18)15(2,20)14(19)11(9)7-21-10/h3-4,6-8,10,12,14,16-17,19-20H,5H2,1-2H3/t8?,10-,12?,14+,15-/m1/s1
InChIKeyIROCKPNYCKETID-QXNAOIDMSA-N
Species of MetaboliteComponentSourceComments
Nigrospora oryzae (ncbitaxon:335854) - PubMed (32401511)
ChEBI Ontology
Outgoing Relation(s)
Nigcollin C (CHEBI:226571) is a benzopyran (CHEBI:22727)
IUPAC Name 
(3S,7S,8S)-3-(3,4-dihydroxypent-1-enyl)-7,8-dihydroxy-7-methyl-4,8-dihydro-3H-isochromen-6-one