CHEBI:85906 - (2R,3S)-2,7-dihydroxy-4'-methoxyisoflavanone

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ChEBI Name (2R,3S)-2,7-dihydroxy-4'-methoxyisoflavanone
ChEBI ID CHEBI:85906
ChEBI ASCII Name (2R,3S)-2,7-dihydroxy-4'-methoxyisoflavanone
Definition A 2,7-dihydroxy-4'-methoxyisoflavanone in which positions 2 and 3 have R- and S-configuration respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C16H14O5
Net Charge 0
Average Mass 286.27940
Monoisotopic Mass 286.08412
InChI InChI=1S/C16H14O5/c1-20-11-5-2-9(3-6-11)14-15(18)12-7-4-10(17)8-13(12)21-16(14)19/h2-8,14,16-17,19H,1H3/t14-,16-/m1/s1
InChIKey PKQQPELXMZRYJY-GDBMZVCRSA-N
SMILES COc1ccc(cc1)[C@H]1[C@H](O)Oc2cc(O)ccc2C1=O
ChEBI Ontology
Outgoing (2R,3S)-2,7-dihydroxy-4'-methoxyisoflavanone (CHEBI:85906) is a 2,7-dihydroxy-4'-methoxyisoflavanone (CHEBI:62734)
IUPAC Name
(2R,3S)-2,7-dihydroxy-3-(4-methoxyphenyl)-2,3-dihydro-4H-1-benzopyran-4-one
Synonym Source
(2R,3S)-2,7-dihydroxy-4'-methoxyisoflavanone UniProt
Manual Xref Database
CPD-3502 MetaCyc
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Registry Number Type Source
10563880 Reaxys Registry Number Reaxys
Last Modified
19 June 2015