chempirical

2,3,5-Tri-O-benzyl-D-ribonolactone

C26H26O5CAS 55094-52-5418.49 g/mol

Open in Covalent MOL file
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EsterEtherLactone

Properties

Molecular formula
C26H26O5
Molar mass
418.49 g/mol
Exact mass
418.1780 Da
logP
4.30Crippen estimate
Polar surface area
54.0 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
10
Stereocentres
R, R, Rin SMILES atom order

Hazards

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

Identifiers

CAS number
55094-52-5
SMILES
C1=CC=C(C=C1)COC[C@@H]2[C@H]([C@H](C(=O)O2)OCC3=CC=CC=C3)OCC4=CC=CC=C4
InChIKey
LDHBSABBBAUMCZ-UBFVSLLYSA-N
InChI
InChI=1S/C26H26O5/c27-26-25(30-18-22-14-8-3-9-15-22)24(29-17-21-12-6-2-7-13-21)23(31-26)19-28-16-20-10-4-1-5-11-20/h1-15,23-25H,16-19H2/t23-,24-,25-/m1/s1

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Names and synonyms

1 names
  • (3R,4R,5R)-3,4-Bis(benzyloxy)-5-((benzyloxy)methyl)dihydrofuran-2(3H)-one

Work with 2,3,5-Tri-O-benzyl-D-ribonolactone

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

2,3,4,6-Tetra-O-benzyl-D-glucono-1,5-lactone13096-62-392 % similar (3R,4S,5R,6R)-3,4,5-Tris(benzyloxy)-6-(((tert-butyldimethylsilyl)oxy)methyl)tetrahydro-2H-pyran-2-one911380-37-560 % similar 1-O-Acetyl-2,3,5-tri-O-benzyl-D-ribofuranose58381-23-054 % similar 2,3,5-Tri-O-benzyl-beta-D-arabinofuranose60933-68-850 % similar 2,3,4,6-Tetrakis-O-(phenylmethyl)-D-glucopyranose4132-28-949 % similar 2,3,4,6-Tetrakis-O-(phenylmethyl)-D-galactopyranose6386-24-949 % similar 2,3,4,6-Tetrakis-O-(phenylmethyl)-α-D-glucopyranose6564-72-349 % similar 3,4,6-Tri-O-benzyl-D-glucal55628-54-148 % similar

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

Elsewhere

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