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(2S)-3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one

PropertiesImage
MNX_IDMNXM7906 Image of MNXM7906
referencemetacycM:CPD-11871
formulaC17H18O6
global charge0
mol weight318.325
InChIKeyBUJCVBRLTBAYCW-INIZCTEOSA-N
InChIInChI=1S/C17H18O6/c1-21-13-5-3-4-6-14(13)23-16(10-18)17(20)11-7-8-12(19)15(9-11)22-2/h3-9,16,18-19H,10H2,1-2H3/t16-/m0/s1
SMILESCOC1=C(O)C=CC(C(=O)[C@H](CO)OC2=C(OC)C=CC=C2)=C1
MNX internals
InChI (mnx)InChI=1/C17H18O6/c1-21-13-5-3-4-6-14(13)23-16(10-18)17(20)11-7-8-12(19)15(9-11)22-2/h3-9,16,18-19H,10H2,1-2H3/t16-/m0/s1 Image of MNXM7906
SMILES (mnx)[CH3:1][O:21][C:13]1=[CH:5][CH:3]=[CH:4][CH:6]=[C:14]1[O:23][C@@H:16]([CH2:10][OH:18])[C:17]([C:11]1=[CH:9][C:15]([O:22][CH3:2])=[C:12]([OH:19])[CH:8]=[CH:7]1)=[O:20]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-11871
metacycM:CPD-11871
BUJCVBRLTBAYCW-INIZCTEOSA-N
(2S)-3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
(+)-(betaS)-MPHPV
(+)-(betaS)-alpha-(2-methoxyphenoxy)-beta-hydroxypropiovanillone
MPHPV I

seed.compound:cpd23120
seedM:cpd23120
BUJCVBRLTBAYCW-INIZCTEOSA-N
(+)-(betaS)-MPHPV
(+)-(betaS)-alpha-(2-methoxyphenoxy)-beta-hydroxypropiovanillone
(2S)-3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)propan-1-one
MPHPV I

seedM:M_cpd23120
secondary/obsolete/fantasy identifier