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CHEBI:226532 - Nigcollin E

ChEBI IDCHEBI:226532
ChEBI NameNigcollin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESCC=CC=C[C@@H]1CC2=C(CO1)[C@@H](O)[C@](C)(O)[C@@H](O)C2
InChIInChI=1S/C15H22O4/c1-3-4-5-6-11-7-10-8-13(16)15(2,18)14(17)12(10)9-19-11/h3-6,11,13-14,16-18H,7-9H2,1-2H3/t11-,13+,14-,15-/m1/s1
InChIKeySYVFTMNVSBBWJI-FAAHXZRKSA-N
Species of MetaboliteComponentSourceComments
Nigrospora oryzae (ncbitaxon:335854) - PubMed (32401511)
ChEBI Ontology
Outgoing Relation(s)
Nigcollin E (CHEBI:226532) is a benzopyran (CHEBI:22727)
IUPAC Name 
(3S,6S,7R,8R)-7-methyl-3-penta-1,3-dienyl-1,3,4,5,6,8-hexahydroisochromene-6,7,8-triol