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CHEBI:36100 - (S)-isoflavan

ChEBI IDCHEBI:36100
ChEBI Name(S)-isoflavan
Stars
ASCII Name(S)-isoflavan
DefinitionThe (S)-enantiomer of isoflavan.
Last Modified9 June 2015
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC15H14O
Net Charge0
Average Mass210.276
Monoisotopic Mass210.10447
SMILESc1ccc([C@H]2COc3ccccc3C2)cc1
InChIInChI=1S/C15H14O/c1-2-6-12(7-3-1)14-10-13-8-4-5-9-15(13)16-11-14/h1-9,14H,10-11H2/t14-/m1/s1
InChIKeyNNQSGBRGJHSRFN-CQSZACIVSA-N
ChEBI Ontology
Outgoing Relation(s)
(S)-isoflavan (CHEBI:36100) is a isoflavan (CHEBI:38740)
(S)-isoflavan (CHEBI:36100) is enantiomer of (R)-isoflavan (CHEBI:36101)
Incoming Relation(s)
(3S,4R)-4' hydroxy-6,3' dimethoxyisoflavan-4-ol (CHEBI:70191) has functional parent (S)-isoflavan (CHEBI:36100)
mucronulatol (CHEBI:7014) has functional parent (S)-isoflavan (CHEBI:36100)
(R)-isoflavan (CHEBI:36101) is enantiomer of (S)-isoflavan (CHEBI:36100)
IUPAC Name 
(3S)-3-phenylchromane
Registry NumbersSources
Reaxys:1426524Reaxys