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CHEBI:191567 - Apimaysin

ChEBI IDCHEBI:191567
ChEBI NameApimaysin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H28O13
Net Charge0
Average Mass560.508
Monoisotopic Mass560.15299
SMILESCC1OC(c2c(O)cc3oc(-c4ccc(O)cc4)cc(=O)c3c2O)C(OC2OC(C)C(O)C(O)C2O)C(O)C1=O
InChIInChI=1S/C27H28O13/c1-9-20(32)23(35)26(40-27-24(36)22(34)19(31)10(2)38-27)25(37-9)18-14(30)8-16-17(21(18)33)13(29)7-15(39-16)11-3-5-12(28)6-4-11/h3-10,19,22-28,30-31,33-36H,1-2H3
InChIKeyLCQVQAZLYBJMGJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
Ulmus parvifolia (ncbitaxon:63058)
seed (BTO:0001226) MetaboLights (MTBLS4572)
bark (BTO:0001301) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
Apimaysin (CHEBI:191567) is a C-glycosyl compound (CHEBI:20857)
Apimaysin (CHEBI:191567) is a flavonoids (CHEBI:72544)
IUPAC Name 
5,7-dihydroxy-6-[4-hydroxy-6-methyl-5-oxo-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]-2-(4-hydroxyphenyl)chromen-4-one
Manual XrefsDatabases
HMDB0037421HMDB
168819ChemSpider
Registry NumbersSources
CAS:74158-04-6ChemIDplus