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CHEBI:175581 - Fragransol C

ChEBI IDCHEBI:175581
ChEBI NameFragransol C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O5
Net Charge0
Average Mass356.418
Monoisotopic Mass356.16237
SMILESCOc1ccc(C2Oc3c(OC)cc(/C=C/CO)cc3C2C)cc1OC
InChIInChI=1S/C21H24O5/c1-13-16-10-14(6-5-9-22)11-19(25-4)21(16)26-20(13)15-7-8-17(23-2)18(12-15)24-3/h5-8,10-13,20,22H,9H2,1-4H3/b6-5+
InChIKeyJRYJEMVPVZEOPW-AATRIKPKSA-N
ChEBI Ontology
Outgoing Relation(s)
Fragransol C (CHEBI:175581) is a benzofurans (CHEBI:35259)
IUPAC Name 
(E)-3-[2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-2,3-dihydro-1-benzouran-5-yl]prop-2-en-1-ol
Manual XrefsDatabases
35013178ChemSpider
HMDB0030333HMDB