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3'-Glucosyl-2',4',6'-trihydroxyacetophenone

PropertiesImage
MNX_IDMNXM117155 Image of MNXM117155
referencechebi:167941
formulaC14H18O9
global charge0
mol weight330.289
InChIKeyIWMUXTZLTOTAQO-UHFFFAOYSA-N
InChIInChI=1S/C14H18O9/c1-4(16)8-5(17)2-6(18)9(11(8)20)14-13(22)12(21)10(19)7(3-15)23-14/h2,7,10,12-15,17-22H,3H2,1H3
SMILESCC(=O)C1=C(O)C=C(O)C(C2OC(CO)C(O)C(O)C2O)=C1O
MNX internals
InChI (mnx)InChI=1/C14H18O9/c1-4(16)8-5(17)2-6(18)9(11(8)20)14-13(22)12(21)10(19)7(3-15)23-14/h2,7,10,12-15,17-22H,3H2,1H3/t7?,10?,12?,13?,14? Image of MNXM117155
SMILES (mnx)[CH3:1][C:4]([C:8]1=[C:11]([OH:20])[C:9]([CH:14]2[CH:13]([OH:22])[CH:12]([OH:21])[CH:10]([OH:19])[CH:7]([CH2:3][OH:15])[O:23]2)=[C:6]([OH:18])[CH:2]=[C:5]1[OH:17])=[O:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:167941
chebi:167941
IWMUXTZLTOTAQO-UHFFFAOYSA-N 		3'-Glucosyl-2',4',6'-trihydroxyacetophenone
1-[2,4,6-trihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl]ethanone
hmdb:HMDB0040621
IWMUXTZLTOTAQO-UHFFFAOYSA-N 		3'-Glucosyl-2',4',6'-trihydroxyacetophenone
1-(3-Glucopyranosyl-2,4,6-trihydroxyphenyl)ethanone, 9ci
1-{2,4,6-trihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}ethan-1-one
1-{2,4,6-trihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}ethanone
2-((1-Methylpropyl)amino)ethanol
2-Acetyl-4-b-D-glucopyranosyl-1,3,5-benzenetriol

hmdb:HMDB40621 		secondary/obsolete/fantasy identifier