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CHEBI:200986 - (1S,3R,4S)-1-(4'-hydroxy-phenyl)-3,4-dihydro-3,4,5-trimethyl-1H-2-benzopyran-6,8-diol

ChEBI IDCHEBI:200986
ChEBI Name(1S,3R,4S)-1-(4'-hydroxy-phenyl)-3,4-dihydro-3,4,5-trimethyl-1H-2-benzopyran-6,8-diol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H20O4
Net Charge0
Average Mass300.354
Monoisotopic Mass300.13616
SMILESCc1c(O)cc(O)c2c1[C@H](C)[C@@H](C)O[C@H]2c1ccc(O)cc1
InChIInChI=1S/C18H20O4/c1-9-11(3)22-18(12-4-6-13(19)7-5-12)17-15(21)8-14(20)10(2)16(9)17/h4-9,11,18-21H,1-3H3/t9-,11-,18+/m1/s1
InChIKeyVJFJLZJZRYKHIS-RRAIRTEYSA-N
Species of MetaboliteComponentSourceComments
Penicillium citrinum (ncbitaxon:5077) - DOI (10.1016/j.phytol.2015.03.007)
ChEBI Ontology
Outgoing Relation(s)
(1S,3R,4S)-1-(4'-hydroxy-phenyl)-3,4-dihydro-3,4,5-trimethyl-1H-2-benzopyran-6,8-diol (CHEBI:200986) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(1S,3R,4S)-1-(4-hydroxyphenyl)-3,4,5-trimethyl-3,4-dihydro-1H-isochromene-6,8-diol
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78442286ChemSpider