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CHEBI:206428 - Penicacid C

ChEBI IDCHEBI:206428
ChEBI NamePenicacid C
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SubmitterMetaboLights
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FormulaC17H22O9
Net Charge0
Average Mass370.354
Monoisotopic Mass370.12638
SMILESCOc1c(C)c2c(c(O)c1CC(O)C(C)(O)C(O)CC(=O)O)C(=O)OC2
InChIInChI=1S/C17H22O9/c1-7-9-6-26-16(23)13(9)14(22)8(15(7)25-3)4-10(18)17(2,24)11(19)5-12(20)21/h10-11,18-19,22,24H,4-6H2,1-3H3,(H,20,21)
InChIKeyHACULPQANLUFJL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (22464133)
ChEBI Ontology
Outgoing Relation(s)
Penicacid C (CHEBI:206428) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
3,4,5-trihydroxy-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzouran-5-yl)-4-methylhexanoic acid
Manual XrefsDatabases
28499557ChemSpider