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CHEBI:17556 - phaseollidin

ChEBI IDCHEBI:17556
ChEBI Namephaseollidin
Stars
DefinitionA member of the class of pterocarpans that is (6aR,11aR)-pterocarpan substituted by hydroxy groups at positions 3 and 9 and a prenyl group at position 10.
Secondary ChEBI IDsCHEBI:8044, CHEBI:14774, CHEBI:25948
Last Modified13 November 2017
DownloadsMolfile
FormulaC20H20O4
Net Charge0
Average Mass324.376
Monoisotopic Mass324.13616
SMILES[H][C@@]12COc3cc(O)ccc3[C@]1([H])Oc1c2ccc(O)c1CC=C(C)C
InChIInChI=1S/C20H20O4/c1-11(2)3-5-14-17(22)8-7-13-16-10-23-18-9-12(21)4-6-15(18)20(16)24-19(13)14/h3-4,6-9,16,20-22H,5,10H2,1-2H3/t16-,20-/m0/s1
InChIKeyOFWYIUYVHYPQNX-JXFKEZNVSA-N
ChEBI Ontology
Outgoing Relation(s)
phaseollidin (CHEBI:17556) is a pterocarpans (CHEBI:26377)
Incoming Relation(s)
phaseollidin hydrate (CHEBI:17465) has functional parent phaseollidin (CHEBI:17556)
IUPAC Name 
(6aR,11aR)-10-(3-methylbut-2-en-1-yl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol
Synonyms  Source
(-)-PhaseollidinKEGG COMPOUND
PhaseollidinKEGG COMPOUND
UniProt Name  Source
phaseollidinUniProt
Manual XrefsDatabases
C00002558KNApSAcK
C00002559KNApSAcK
C05230KEGG COMPOUND
C10514KEGG COMPOUND
HMDB0033669HMDB
LMPK12070011LIPID MAPS
Registry NumbersSources
Reaxys:4820124Reaxys
CAS:13401-40-6KEGG COMPOUND
CAS:37831-70-2KEGG COMPOUND
CAS:37831-70-2ChemIDplus
Citations