(2R,3R,4S,5R,6S)-2-(Hydroxymethyl)-6-(p-tolylthio)tetrahydro-2H-pyran-3,4,5-triol

HCID 7315241

Basic information

Standard SMILES
Cc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1
InChIKey
IQCLIQLFPVKINX-SJHCENCUSA-N
Molecular formula
C13H18O5S
Average molar mass
286.35 g/mol

Names & identifiers

Preferred name
(2R,3R,4S,5R,6S)-2-(Hydroxymethyl)-6-(p-tolylthio)tetrahydro-2H-pyran-3,4,5-triol
IUPAC
(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(4-methylphenyl)sulfanyloxane-3,4,5-triol

Names & synonyms

28244-98-64-METHYLPHENYLTHIO-BETA-D-GALACTOPYRANOSIDE(2R,3R,4S,5R,6S)-2-(Hydroxymethyl)-6-(p-tolylthio)tetrahydro-2H-pyran-3,4,5-triol4-Methylphenyl 1-thio-b-D-galactopyranosideCHEMBL4064722MFCD04973631(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(4-methylphenyl)sulfanyloxane-3,4,5-triol4-Methylphenylthio-b-D-galactopyranoside4-Methylphenyl 1-thio-beta-D-galactopyranosideSCHEMBL3824089IQCLIQLFPVKINX-SJHCENCUSA-NBDBM50247500
Show more names
p-Tolyl 1-Thio--D-galactopyranosidep-Tolyl 1-Thio-b-D-galactopyranosid4-Methylphenylb-D-thiogalactopyranoside4-Methylphenylthio--D-galactopyranosideMM049464-Methylphenyl ?-D-thiogalactopyranoside4-Methylphenylthio-?-D-galactopyranoside4-Methylphenylthio-|A-D-galactopyranoside

Database identifiers

PubChem CID
7315241
ChEMBL
CHEMBL4064722
Nikkaji
J1.643.522H

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
115 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
19

Related reactions

4 records

Compound notes

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