chempirical

Xylobiose

C10H18O9CAS 6860-47-5282.25 g/mol

Open in Covalent MOL file
OOHOHHOOOOHOHHO
AcetalAlcoholAldehydeEther

Properties

Molecular formula
C10H18O9
Molar mass
282.25 g/mol
Exact mass
282.0951 Da
Melting point
186–187 °C
logP
-4.28Crippen estimate
Polar surface area
156.9 Ų
H-bond donors / acceptors
6 / 9
Rotatable bonds
6
Stereocentres
R, R, R, S, R, S, Rin SMILES atom order

Identifiers

CAS number
6860-47-5
SMILES
O=C[C@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O
InChIKey
SQNRKWHRVIAKLP-RSZZQXBVSA-N
InChI
InChI=1S/C10H18O9/c11-1-4(13)7(15)6(2-12)19-10-9(17)8(16)5(14)3-18-10/h1,4-10,12-17H,2-3H2/t4-,5+,6+,7+,8-,9+,10-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • D-Xylose, 4-O-β-D-xylopyranosyl-
  • 4-O-β-D-Xylopyranosyl-D-xylose
  • 1,4-β-Xylobiose

Work with Xylobiose

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

Isomaltose499-40-190 % similar Gentiobiose554-91-690 % similar Melibiose585-99-990 % similar Manninotriose13382-86-085 % similar Isomaltitol534-73-665 % similar Isomalt64519-82-065 % similar Cellobiose528-50-762 % similar Lactose63-42-362 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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