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CHEBI:223796 - 3-hydroxyhericenone F

ChEBI IDCHEBI:223796
ChEBI Name3-hydroxyhericenone F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H54O7
Net Charge0
Average Mass586.810
Monoisotopic Mass586.38695
SMILESCCCCCCCCCCCCCCCC(=O)OCc1cc(OC)c2c(c1C=O)O[C@@](C)(CC(=O)C=C(C)C)[C@@H](O)C2
InChIInChI=1S/C35H54O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-33(39)41-25-27-21-31(40-5)29-22-32(38)35(4,23-28(37)20-26(2)3)42-34(29)30(27)24-36/h20-21,24,32,38H,6-19,22-23,25H2,1-5H3/t32-,35-/m0/s1
InChIKeyVRVNUMYDBOJZOP-SHUZPENHSA-N
Species of MetaboliteComponentSourceComments
Hericium erinaceus (ncbitaxon:91752) - PubMed (18835171)
ChEBI Ontology
Outgoing Relation(s)
3-hydroxyhericenone F (CHEBI:223796) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
[(2S,3S)-8-ormyl-3-hydroxy-5-methoxy-2-methyl-2-(4-methyl-2-oxopent-3-enyl)-3,4-dihydrochromen-7-yl]methyl hexadecanoate
Manual XrefsDatabases
24686269ChemSpider