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CHEBI:220130 - (3'S*,4'R*)-6-(3',5-epoxy-4'-hydroxy-1'-heptenyl)-2-hydroxy-3-(3"-methyl-2"-butenyl)benzaldehyde

ChEBI IDCHEBI:220130
ChEBI Name(3'S*,4'R*)-6-(3',5-epoxy-4'-hydroxy-1'-heptenyl)-2-hydroxy-3-(3"-methyl-2"-butenyl)benzaldehyde
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H24O4
Net Charge0
Average Mass316.397
Monoisotopic Mass316.16746
SMILESCCC[C@@H](O)[C@@H]1C=Cc2c(cc(CC=C(C)C)c(O)c2C=O)O1
InChIInChI=1S/C19H24O4/c1-4-5-16(21)17-9-8-14-15(11-20)19(22)13(7-6-12(2)3)10-18(14)23-17/h6,8-11,16-17,21-22H,4-5,7H2,1-3H3/t16-,17+/m1/s1
InChIKeyCZWWFFQRDUGZLF-SJORKVTESA-N
Species of MetaboliteComponentSourceComments
Eurotiumspecies (ncbitaxon:1859957) - PubMed (27627699)
ChEBI Ontology
Outgoing Relation(s)
(3'S*,4'R*)-6-(3',5-epoxy-4'-hydroxy-1'-heptenyl)-2-hydroxy-3-(3"-methyl-2"-butenyl)benzaldehyde (CHEBI:220130) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(2S)-6-hydroxy-2-[(1R)-1-hydroxybutyl]-7-(3-methylbut-2-enyl)-2H-chromene-5-carbaldehyde
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60958471ChemSpider