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CHEBI:222577 - Pestalotioquinol B

ChEBI IDCHEBI:222577
ChEBI NamePestalotioquinol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28O4
Net Charge0
Average Mass344.451
Monoisotopic Mass344.19876
SMILESC=C(C#Cc1cc(O)ccc1O)CCC(O)C(C)(O)CCC=C(C)C
InChIInChI=1S/C21H28O4/c1-15(2)6-5-13-21(4,25)20(24)12-8-16(3)7-9-17-14-18(22)10-11-19(17)23/h6,10-11,14,20,22-25H,3,5,8,12-13H2,1-2,4H3
InChIKeyLUGRIUYDFNGPFZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis microspora (ncbitaxon:85828) - PubMed (31341274)
ChEBI Ontology
Outgoing Relation(s)
Pestalotioquinol B (CHEBI:222577) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
2-(6,7-dihydroxy-7,11-dimethyl-3-methylidenedodec-10-en-1-ynyl)benzene-1,4-diol