β-D-Glucose pentaacetate

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Systematic / IUPAC Name: [(2R,3R,4S,5R,6S)-3,4,5,6-Tetraacetyloxyoxan-2-yl]methyl acetate

ID: Reference13621

Other Names: AA-3647

Formula: C16H22O11

Class: Endogenous Metabolites

Spectral Data

β-D-Glucose pentaacetate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 1
No. of Spectra 325
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 10/24/2025 4:43:29 PM
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Identificators

InChI InChI=1S/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3/t12-,13-,14+,15-,16-/m1/s1
InChI Key LPTITAGPBXDDGR-IBEHDNSVSA-N
Canonical SMILES CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
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Other Names AA-3647

In Other Databases

PubChem 2724702
ChemSpider 2006823
ChEMBL CHEMBL438446
HMDb HMDB0034223