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(+/-)-3-(4-Hydroxyphenyl)-1,2-propanediol 4'-O-glucoside

PropertiesImage
MNX_IDMNXM115591 Image of MNXM115591
referencechebi:168169
formulaC15H22O8
global charge0
mol weight330.333
InChIKeyUBOMSXSQLRMBSD-UHFFFAOYSA-N
InChIInChI=1S/C15H22O8/c16-6-9(18)5-8-1-3-10(4-2-8)22-15-14(21)13(20)12(19)11(7-17)23-15/h1-4,9,11-21H,5-7H2
SMILESOCC(O)CC1=CC=C(OC2OC(CO)C(O)C(O)C2O)C=C1
MNX internals
InChI (mnx)InChI=1/C15H22O8/c16-6-9(18)5-8-1-3-10(4-2-8)22-15-14(21)13(20)12(19)11(7-17)23-15/h1-4,9,11-21H,5-7H2/t9?,11?,12?,13?,14?,15? Image of MNXM115591
SMILES (mnx)[CH:1]1=[CH:3][C:10]([O:22][CH:15]2[CH:14]([OH:21])[CH:13]([OH:20])[CH:12]([OH:19])[CH:11]([CH2:7][OH:17])[O:23]2)=[CH:4][CH:2]=[C:8]1[CH2:5][CH:9]([CH2:6][OH:16])[OH:18]
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

hmdb:HMDB0033082
CHEBI:168169
chebi:168169
UBOMSXSQLRMBSD-UHFFFAOYSA-N
(+/-)-3-(4-Hydroxyphenyl)-1,2-propanediol 4'-O-glucoside
2-[4-(2,3-dihydroxypropyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

hmdb:HMDB33082
secondary/obsolete/fantasy identifier