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CHEBI:205688 - Maculansline C

ChEBI IDCHEBI:205688
ChEBI NameMaculansline C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O5
Net Charge0
Average Mass266.293
Monoisotopic Mass266.11542
SMILESCCC[C@@H](O)C[C@@H]1Cc2cc(O)cc(O)c2C(=O)O1
InChIInChI=1S/C14H18O5/c1-2-3-9(15)6-11-5-8-4-10(16)7-12(17)13(8)14(18)19-11/h4,7,9,11,15-17H,2-3,5-6H2,1H3/t9-,11+/m1/s1
InChIKeyGUPPCWWAWQRGBV-KOLCDFICSA-N
Species of MetaboliteComponentSourceComments
Plenodomus lingam (ncbitaxon:5022) - PubMed (29966449)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Maculansline C (CHEBI:205688) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(3S)-6,8-dihydroxy-3-[(2R)-2-hydroxypentyl]-3,4-dihydroisochromen-1-one