1,3,4,6-Tetra-O-acetyl-β-D-mannopyranose

C14H20O10CAS 18968-05-3348.30 g/mol

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AcetalAlcoholEsterEther

Properties

Molecular formula
C14H20O10
Molar mass
348.30 g/mol
Exact mass
348.1056 Da
logP
-0.94Crippen estimate
Polar surface area
134.7 Ų
H-bond donors / acceptors
1 / 10
Rotatable bonds
5
Stereocentres
R, S, S, R, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
18968-05-3
SMILES
CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@@H](O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
InChIKey
SHBHJRVMGYVXKK-XVIXHAIJSA-N
InChI
InChI=1S/C14H20O10/c1-6(15)20-5-10-12(21-7(2)16)13(22-8(3)17)11(19)14(24-10)23-9(4)18/h10-14,19H,5H2,1-4H3/t10-,11+,12-,13-,14-/m1/s1

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Names and synonyms

2 names
  • β-D-Mannopyranose, 1,3,4,6-tetraacetate
  • Mannopyranose, 1,3,4,6-tetraacetate, β-D-

Work with 1,3,4,6-Tetra-O-acetyl-β-D-mannopyranose

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,2,3,5-Tetra-O-acetyl-β-D-ribofuranose13035-61-575 % similar 1,2,3,5-Tetra-O-acetyl--L-ribofuranose144490-03-975 % similar ((2R,3S,4S,5R)-3,4,5,6-Tetrakis(acetyloxy)oxan-2-yl)methyl acetate25878-60-873 % similar Penta-O-acetyl-α-D-galactopyranose4163-59-173 % similar β-D-Galactose pentaacetate4163-60-473 % similar α-D-Mannose pentaacetate4163-65-973 % similar Alpha-D-glucose pentaacetate604-68-273 % similar Beta-D-Glucose pentaacetate604-69-373 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,2,3,4-Tetra-O-acetyl-β-D-glucopyranose13100-46-4

Elsewhere

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