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1,2-bis-(3,4-dimethoxyphenyl)propane-1,3-diol

PropertiesImage
MNX_IDMNXM4936 Image of MNXM4936
referencechebi:27670
formulaC19H24O6
global charge0
mol weight348.395
InChIKeyMLKIARXZUAHWAV-UHFFFAOYSA-N
InChIInChI=1S/C19H24O6/c1-22-15-7-5-12(9-17(15)24-3)14(11-20)19(21)13-6-8-16(23-2)18(10-13)25-4/h5-10,14,19-21H,11H2,1-4H3
SMILESCOC1=C(OC)C=C(C(O)C(CO)C2=CC(OC)=C(OC)C=C2)C=C1
MNX internals
InChI (mnx)InChI=1/C19H24O6/c1-22-15-7-5-12(9-17(15)24-3)14(11-20)19(21)13-6-8-16(23-2)18(10-13)25-4/h5-10,14,19-21H,11H2,1-4H3/t14?,19? Image of MNXM4936
SMILES (mnx)[CH3:1][O:22][C:15]1=[C:17]([O:24][CH3:3])[CH:9]=[C:12]([CH:14]([CH2:11][OH:20])[CH:19]([C:13]2=[CH:10][C:18]([O:25][CH3:4])=[C:16]([O:23][CH3:2])[CH:8]=[CH:6]2)[OH:21])[CH:5]=[CH:7]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:27670
chebi:27670
MLKIARXZUAHWAV-UHFFFAOYSA-N 		1,2-bis-(3,4-dimethoxyphenyl)propane-1,3-diol
1,2-bis(3,4-dimethoxyphenyl)propane-1,3-diol

kegg.compound:C04597
keggC:C04597
MLKIARXZUAHWAV-UHFFFAOYSA-N 		1,2-Bis(3,4-dimethoxyphenyl)propane-1,3-diol
1,2-Bis(3,4-dimethoxyphenyl)-1,3-propanediol

seed.compound:cpd02802
seedM:cpd02802
MLKIARXZUAHWAV-UHFFFAOYSA-N 		1,2-Bis(3,4-dimethoxyphenyl)propane-1,3-diol
1,2-Bis(3,4-dimethoxyphenyl)-1,3-propanediol
1,2-bis(3,4-dimethoxyphenyl)propane-1,3-diol

metacyc.compound:12-BIS34-DIMETHOXYPHENYLPROPANE-13-
metacycM:12-BIS34-DIMETHOXYPHENYLPROPANE-13-
MLKIARXZUAHWAV-UHFFFAOYSA-N 		1,2-bis(3,4-dimethoxyphenyl)propane-1,3-diol

chebi:11141
chebi:18867
chebi:485
keggC:M_C04597
seedM:M_cpd02802 		secondary/obsolete/fantasy identifier