1,2,3,5-Tetra-O-benzoyl-2-C-methyl-β-D-ribofuranose

C34H28O9CAS 15397-15-6580.59 g/mol

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AcetalEsterEther

Properties

Molecular formula
C34H28O9
Molar mass
580.59 g/mol
Exact mass
580.1733 Da
Melting point
155–156 °C
logP
5.27Crippen estimate
Polar surface area
114.4 Ų
H-bond donors / acceptors
0 / 9
Rotatable bonds
9
Stereocentres
R, 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
15397-15-6
SMILES
C[C@]1(OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)O[C@H](COC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1
InChIKey
QJZSLTLDMBDKOU-VBHQRPIPSA-N
InChI
InChI=1S/C34H28O9/c1-34(43-32(38)26-20-12-5-13-21-26)28(41-30(36)24-16-8-3-9-17-24)27(22-39-29(35)23-14-6-2-7-15-23)40-33(34)42-31(37)25-18-10-4-11-19-25/h2-21,27-28,33H,22H2,1H3/t27-,28-,33+,34-/m1/s1

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Names and synonyms

3 names
  • β-D-Ribofuranose, 2-C-methyl-, 1,2,3,5-tetrabenzoate
  • Ribofuranose, 2-C-methyl-, tetrabenzoate, β-D-
  • β-D-Ribofuranose, 2-C-methyl-, tetrabenzoate

Work with 1,2,3,5-Tetra-O-benzoyl-2-C-methyl-β-D-ribofuranose

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-Deoxy-2,2-difluoro-D-erythro-pentofuranose-3,5-dibenzoate-1-methanesulfonate122111-11-957 % similar α-D-Erythro-Pentofuranose, 2-deoxy-2,2-difluoro-, 3,5-dibenzoate 1-methanesulfonate134877-42-257 % similar 3,5-Di-O-benzoyl-2-deoxy-2,2-difluoro-beta-L-erythro-pentofuranose153012-08-955 % similar (2R)-2-Deoxy-2-fluoro-2-methyl-D-erythro-pentonic acid γ-lactone 3,5-dibenzoate874638-80-955 % similar (2R,3R)-2-[(Benzoyloxy)methyl]-4,4-difluoro-5-oxooxolan-3-yl benzoate122111-01-752 % similar Alpha-D-glucopyranose pentabenzoate22415-91-449 % similar Penta-O-benzoyl-alpha-D-mannopyranose41569-33-949 % similar 1,2,3,4,6-Penta-O-benzoyl-D-mannopyranose96996-90-649 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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