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(2R,3S)-2,4',7-trihydroxyisoflavanone

PropertiesImage
MNX_IDMNXM722745 Image of MNXM722745
referencechebi:63325
formulaC15H12O5
global charge0
mol weight272.256
InChIKeyYACUBWOKTPOMNW-UKRRQHHQSA-N
InChIInChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-14(18)11-6-5-10(17)7-12(11)20-15(13)19/h1-7,13,15-17,19H/t13-,15-/m1/s1
SMILESO=C1C2=C(C=C(O)C=C2)O[C@@H](O)[C@@H]1C1=CC=C(O)C=C1
MNX internals
InChI (mnx)InChI=1/C15H12O5/c16-9-3-1-8(2-4-9)13-14(18)11-6-5-10(17)7-12(11)20-15(13)19/h1-7,13,15-17,19H/t13-,15-/m1/s1 Image of MNXM722745
SMILES (mnx)[CH:1]1=[CH:3][C:9]([OH:16])=[CH:4][CH:2]=[C:8]1[C@@H:13]1[C:14](=[O:18])[C:11]2=[C:12]([CH:7]=[C:10]([OH:17])[CH:5]=[CH:6]2)[O:20][C@H:15]1[OH:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:63325
chebi:63325
YACUBWOKTPOMNW-UKRRQHHQSA-N 		(2R,3S)-2,4',7-trihydroxyisoflavanone
(2R,3S)-2,7-dihydroxy-3-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one

metacyc.compound:2-HYDROXYISOFLAVANONE
metacycM:2-HYDROXYISOFLAVANONE
YACUBWOKTPOMNW-UKRRQHHQSA-N 		(2R,3S)-2,4',7-trihydroxyisoflavanone
2,4',7-trihydroxyisoflavanone

CHEBI:52047
chebi:52047
YACUBWOKTPOMNW-UHFFFAOYSA-N 		2,4',7-trihydroxyisoflavanone
2,7,4'-Trihydroxyisoflavanone
2,7-dihydroxy-3-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one
2,7-dihydroxy-3-(4-hydroxyphenyl)chroman-4-one

sabiork.compound:23311
sabiorkM:23311
YACUBWOKTPOMNW-UHFFFAOYSA-N 		2,7,4'-Trihydroxyisoflavanone

seed.compound:cpd11233
seedM:cpd11233
YACUBWOKTPOMNW-UKRRQHHQSA-N 		2,7,4'-Trihydroxyisoflavanone
(2R,3S)-2,4',7-trihydroxyisoflavanone
2,4',7-trihydroxyisoflavanone
2,7,4'-trihydroxyisoflavanone
2-hydroxyisoflavanone

kegg.compound:C15567
keggC:C15567
YACUBWOKTPOMNW-UHFFFAOYSA-N 		2,7,4'-Trihydroxyisoflavanone
2,4',7-Trihydroxyisoflavanone
hmdb:HMDB0304047
YACUBWOKTPOMNW-UHFFFAOYSA-N 		2,7,4'-trihydroxyisoflavanone
2,4',7-Trihydroxyisoflavanone
2,7,4'-Trihydroxyisoflavanone
2,7-dihydroxy-3-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one

vmhM:thiflvn
vmhmetabolite:thiflvn
YACUBWOKTPOMNW-UHFFFAOYSA-N 		2,7,4-Trihydroxyisoflavanone

keggC:M_C15567
seedM:M_cpd11233
vmhM:M_thiflvn 		secondary/obsolete/fantasy identifier