Nystose

C24H42O21CAS 13133-07-8666.58 g/mol

Open in Covalent MOL file
HOOHOOOOOOHOHOHHOOOHOHOHOHOHOOHOHOH
AcetalAlcoholEther

Properties

Molecular formula
C24H42O21
Molar mass
666.58 g/mol
Exact mass
666.2219 Da
Melting point
130–133 °C
logP
-9.74Crippen estimate
Polar surface area
347.8 Ų
H-bond donors / acceptors
14 / 21
Rotatable bonds
13
Stereocentres
R, R, R, S, R, R, S, S, R, R, S, S, R, S, S, S, Sin 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
13133-07-8
SMILES
OC[C@H]1O[C@@](CO)(OC[C@@]2(OC[C@@]3(O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O
InChIKey
FLDFNEBHEXLZRX-DLQNOBSRSA-N
InChI
InChI=1S/C24H42O21/c25-1-8-12(30)16(34)17(35)21(41-8)45-24(20(38)15(33)11(4-28)44-24)7-40-23(19(37)14(32)10(3-27)43-23)6-39-22(5-29)18(36)13(31)9(2-26)42-22/h8-21,25-38H,1-7H2/t8-,9-,10-,11-,12-,13-,14-,15-,16+,17-,18+,19+,20+,21-,22-,23-,24+/m1/s1

Weigh it out

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

Names and synonyms

6 names
  • α-D-Glucopyranoside, O-β-D-fructofuranosyl-(2→1)-O-β-D-fructofuranosyl-(2→1)-β-D-fructofuranosyl
  • Glucopyranoside, O-β-D-fructofuranosyl-(2→1)-O-β-D-fructofuranosyl-(2→1)-β-D-fructofuranosyl, α-D-
  • O-β-D-Fructofuranosyl-(2→1)-O-β-D-fructofuranosyl-(2→1)-β-D-fructofuranosyl α-D-glucopyranoside
  • Fructosyl-(2→1)-fructosyl-(2→1)-fructosyl-(2→1)-glucose
  • Fungitetraose
  • 1,1-Kestotetraose

Work with Nystose

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

1F-Fructofuranosylnystose59432-60-9100 % similar Fructoheptasaccharide62512-20-3100 % similar Kestose470-69-998 % similar Sucrose57-50-180 % similar Raffinose512-69-670 % similar Stachyose tetrahydrate10094-58-366 % similar D-Raffinose pentahydrate17629-30-066 % similar Epichlorohydrin-sucrose copolymer26873-85-863 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Maltotetraose34612-38-9 Glycogen9005-79-2

Elsewhere

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