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3',4'-dimethylmyricetin

PropertiesImage
MNX_IDMNXM62751 Image of MNXM62751
referencemetacycM:CPD-14935
formulaC17H13O8
global charge-1
mol weight345.283
InChIKeyXRVWAQDGOCLFAE-UHFFFAOYSA-M
InChIInChI=1S/C17H14O8/c1-23-12-4-7(3-10(20)17(12)24-2)16-15(22)14(21)13-9(19)5-8(18)6-11(13)25-16/h3-6,18-20,22H,1-2H3/p-1
SMILESCOC1=CC(C2=C([O-])C(=O)C3=C(C=C(O)C=C3O)O2)=CC(O)=C1OC
MNX internals
InChI (mnx)InChI=1/C17H14O8/c1-23-12-4-7(3-10(20)17(12)24-2)16-15(22)14(21)13-9(19)5-8(18)6-11(13)25-16/h3-6,18-20,22H,1-2H3 Image of MNXM62751
SMILES (mnx)[CH3:1][O:23][C:12]1=[CH:4][C:7]([C:16]2=[C:15]([OH:22])[C:14](=[O:21])[C:13]3=[C:9]([OH:19])[CH:5]=[C:8]([OH:18])[CH:6]=[C:11]3[O:25]2)=[CH:3][C:10]([OH:20])=[C:17]1[O:24][CH3:2]
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

metacyc.compound:CPD-14935
metacycM:CPD-14935
seed.compound:cpd32949
seedM:cpd32949
XRVWAQDGOCLFAE-UHFFFAOYSA-L
XRVWAQDGOCLFAE-UHFFFAOYSA-M
3',4'-dimethylmyricetin
myricetin 3',4'-dimethyl ether

lipidmaps:LMPK12112509
lipidmapsM:LMPK12112509
XRVWAQDGOCLFAE-UHFFFAOYSA-N
Myricetin 3',4'-dimethyl ether

seedM:M_cpd32949
secondary/obsolete/fantasy identifier