2,3,4,6-Tetrakis-O-(phenylmethyl)-D-galactopyranose

C₃₄H₃₆O₆CAS 6386-24-9540.66 g/mol

Open in Covalent MOL file

Alcohol Ether

Properties

Molecular formula: C₃₄H₃₆O₆
Molar mass: 540.66 g/mol
Exact mass: 540.2512 Da
logP: 5.68Crippen estimate
Polar surface area: 66.4 Å²
H-bond donors / acceptors: 1 / 6
Rotatable bonds: 13
Stereocentres: R, S, S, Rin SMILES atom order

Hazards

Warning

H315 Causes skin irritation33.3% of notifiers
H319 Causes serious eye irritation33.3% of notifiers
H335 May cause respiratory irritation33.3% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

6386-24-9

SMILES

OC1O[C@H](COCc2ccccc2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1

InChIKey

OGOMAWHSXRDAKZ-BJPULKCASA-N

InChI

InChI=1S/C34H36O6/c35-34-33(39-24-29-19-11-4-12-20-29)32(38-23-28-17-9-3-10-18-28)31(37-22-27-15-7-2-8-16-27)30(40-34)25-36-21-26-13-5-1-6-14-26/h1-20,30-35H,21-25H2/t30-,31+,32+,33-,34?/m1/s1

Weigh it out

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

Names and synonyms

3 names

D-Galactopyranose, 2,3,4,6-tetrakis-O-(phenylmethyl)-
Galactopyranose, 2,3,4,6-tetra-O-benzyl-, D-
Galactopyranose, 2,3,4,6-tetra-O-benzyl-

Work with 2,3,4,6-Tetrakis-O-(phenylmethyl)-D-galactopyranose

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2,3,4,6-Tetrakis-O-(phenylmethyl)-D-glucopyranose4132-28-9Diastereomer 2,3,4,6-Tetrakis-O-(phenylmethyl)-α-D-glucopyranose6564-72-3Stereoisomer

Similar compounds

2,3,5-Tri-O-benzyl-beta-D-arabinofuranose60933-68-897 % similar Methyl 2,3,4,6-tetra-O-benzyl-α-D-galactopyranoside53008-63-263 % similar Tribenoside10310-32-453 % similar 1-O-Acetyl-2,3,5-tri-O-benzyl-D-ribofuranose58381-23-053 % similar 2 3 4 6-Tetra-O-benzyl-alpha-D-glucopyr&74808-09-653 % similar 2,3,4,6-Tetra-O-benzyl-D-glucono-1,5-lactone13096-62-351 % similar 1,2-O-(1-Methylethylidene)-3,5,6-tris-O-(phenylmethyl)-α-D-glucofuranose53928-30-651 % similar (1S,2R,3S,5R)-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane110567-22-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(2R,3S,4S,5R)-2,3,4,6-Tetrakis(benzyloxy)-5-hydroxyhexanal53081-25-7

Elsewhere

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