Search MNXref
 Feedback

4-Hydroxy-3-(2-hydroxyethyl)acetophenone 4-glucoside

PropertiesImage
MNX_IDMNXM117910 Image of MNXM117910
referencechebi:175339
formulaC16H22O8
global charge0
mol weight342.344
InChIKeyNHMZPJFIGAJCPH-UHFFFAOYSA-N
InChIInChI=1S/C16H22O8/c1-8(19)9-2-3-11(10(6-9)4-5-17)23-16-15(22)14(21)13(20)12(7-18)24-16/h2-3,6,12-18,20-22H,4-5,7H2,1H3
SMILESCC(=O)C1=CC(CCO)=C(OC2OC(CO)C(O)C(O)C2O)C=C1
MNX internals
InChI (mnx)InChI=1/C16H22O8/c1-8(19)9-2-3-11(10(6-9)4-5-17)23-16-15(22)14(21)13(20)12(7-18)24-16/h2-3,6,12-18,20-22H,4-5,7H2,1H3/t12?,13?,14?,15?,16? Image of MNXM117910
SMILES (mnx)[CH3:1][C:8]([C:9]1=[CH:6][C:10]([CH2:4][CH2:5][OH:17])=[C:11]([O:23][CH:16]2[CH:15]([OH:22])[CH:14]([OH:21])[CH:13]([OH:20])[CH:12]([CH2:7][OH:18])[O:24]2)[CH:3]=[CH:2]1)=[O:19]
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:175339
chebi:175339
NHMZPJFIGAJCPH-UHFFFAOYSA-N 		4-Hydroxy-3-(2-hydroxyethyl)acetophenone 4-glucoside
1-[3-(2-hydroxyethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone
hmdb:HMDB0037552
NHMZPJFIGAJCPH-UHFFFAOYSA-N 		4-Hydroxy-3-(2-hydroxyethyl)acetophenone 4-glucoside
1-[3-(2-hydroxyethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl]ethan-1-one
1-[3-(2-hydroxyethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl]ethanone

hmdb:HMDB37552 		secondary/obsolete/fantasy identifier