Methyl 2-deoxy-D-erythro-pentofuranoside

C6H12O4CAS 60134-26-1148.16 g/mol

Open in Covalent MOL file
OOOHOH
AcetalAlcoholEther

Properties

Molecular formula
C6H12O4
Molar mass
148.16 g/mol
Exact mass
148.0736 Da
logP
-0.90Crippen estimate
Polar surface area
58.9 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
2
Stereocentres
S, Rin SMILES atom order

Hazards

Not classified as hazardous under GHS. Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
60134-26-1
SMILES
COC1C[C@@H]([C@H](O1)CO)O
InChIKey
NVGJZDFWPSOTHM-YRZWDFBDSA-N
InChI
InChI=1S/C6H12O4/c1-9-6-2-4(8)5(3-7)10-6/h4-8H,2-3H2,1H3/t4-,5+,6?/m0/s1

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Names and synonyms

1 names
  • 1-O-Methyl-2-deoxy-D-ribose

Work with Methyl 2-deoxy-D-erythro-pentofuranoside

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

2,2-Dimethoxyethanol30934-97-548 % similar 3-O-Methyl-α-D-glucopyranose13224-94-744 % similar Methyl β-D-ribofuranoside7473-45-244 % similar Methyl beta-D-galactopyranoside1824-94-843 % similar Methyl alpha-D-galactopyranoside3396-99-443 % similar Methyl alpha-D-mannopyranoside617-04-943 % similar Methyl β-D-glucopyranoside709-50-243 % similar Methyl D-galactopyranoside93302-26-243 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,2-Bis(hydroxymethyl)butanoic acid10097-02-6 Hydroxypropyl acrylate25584-83-2 Aldehydo-D-digitoxose527-52-6 Methyl 3,3-dimethoxypropionate7424-91-1

Elsewhere

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