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CHEBI:175759 - Fragransol D

ChEBI IDCHEBI:175759
ChEBI NameFragransol D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O6
Net Charge0
Average Mass370.401
Monoisotopic Mass370.14164
SMILESCOc1cc(C2Oc3c(OC)cc(/C=C/CO)cc3C2C)cc2c1OCO2
InChIInChI=1S/C21H22O6/c1-12-15-7-13(5-4-6-22)8-16(23-2)20(15)27-19(12)14-9-17(24-3)21-18(10-14)25-11-26-21/h4-5,7-10,12,19,22H,6,11H2,1-3H3/b5-4+
InChIKeyALMMZKOPVITQNK-SNAWJCMRSA-N
ChEBI Ontology
Outgoing Relation(s)
Fragransol D (CHEBI:175759) is a benzofurans (CHEBI:35259)
IUPAC Name 
(E)-3-[7-methoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-2,3-dihydro-1-benzouran-5-yl]prop-2-en-1-ol
Manual XrefsDatabases
HMDB0030439HMDB
35013195ChemSpider