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CHEBI:224481 - Structure II

ChEBI IDCHEBI:224481
ChEBI NameStructure II
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SubmitterMetaboLights
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FormulaC17H20O7
Net Charge0
Average Mass336.340
Monoisotopic Mass336.12090
SMILESCOc1c(C)c2c(c(O)c1CC(O)C1(C)CCC(=O)O1)C(=O)OC2
InChIInChI=1S/C17H20O7/c1-8-10-7-23-16(21)13(10)14(20)9(15(8)22-3)6-11(18)17(2)5-4-12(19)24-17/h11,18,20H,4-7H2,1-3H3
InChIKeyWSNMPAVSZJSIMT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium brevicompactum (ncbitaxon:5074) - DOI (10.1016/s0040-4039(01)89288-1)
ChEBI Ontology
Outgoing Relation(s)
Structure II (CHEBI:224481) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
7-hydroxy-6-[2-hydroxy-2-(2-methyl-5-oxooxolan-2-yl)ethyl]-5-methoxy-4-methyl-3H-2-benzouran-1-one
Manual XrefsDatabases
78435834ChemSpider