Melezitose

Systematic / IUPAC Name: α-D-Glucopyranosyl-(1->3)-β-D-fructofuranosyl α-D-glucopyranoside

ID: Reference788

Other Names: (2R,3R,4S,5S,6R)-2-{[(2S,3S,4R,5R)-4-Hydroxy-2,5-bis(hydroxymethyl)-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol;
D-Melezitose;
Melicitose;
α-D-Glucopyranoside, O-α-D-glucopyranosyl-(1-3)-β-D-fructofuranosyl-;
O-α-D-Glucopyranosyl-(1-3)-β-D-fructofuranosyl-α-D-glucopyranoside

Formula: C18H32O16

Class: Endogenous Metabolites

Spectral Data

Melezitose mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 47
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/9/2015 4:52:07 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-15-10(25)7(3-21)33-18(15,4-22)34-17-14(29)12(27)9(24)6(2-20)31-17/h5-17,19-29H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16-,17-,18+/m1/s1
InChI Key QWIZNVHXZXRPDR-WSCXOGSTSA-N
Canonical SMILES
CAS 597126
Splash
Other Names (2R,3R,4S,5S,6R)-2-{[(2S,3S,4R,5R)-4-Hydroxy-2,5-bis(hydroxymethyl)-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol;
D-Melezitose;
Melicitose;
α-D-Glucopyranoside, O-α-D-glucopyranosyl-(1-3)-β-D-fructofuranosyl-;
O-α-D-Glucopyranosyl-(1-3)-β-D-fructofuranosyl-α-D-glucopyranoside

In Other Databases

HMDb HMDB11730
ChEBI CHEBI:6731
ChemIDPlus 000597126
ChemSpider 190749
KEGG C08243
ChEMBL CHEMBL386007
Wikipedia Melezitose
PubChem 92817