1,2,3,4-tetra-O-acetyl-5-thio-D-xylopyranose

HCID 10991244
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Basic information

Standard SMILES
CC(=O)OC1SC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O
InChIKey
JEGLENJOJVLAIW-DAAZQVBGSA-N
Molecular formula
C13H18O8S
Average molar mass
334.34 g/mol

Names & identifiers

Preferred name
1,2,3,4-tetra-O-acetyl-5-thio-D-xylopyranose
IUPAC
[(3S,4S,5R)-4,5,6-triacetyloxythian-3-yl] acetate

Names & synonyms

SCHEMBL315502JEGLENJOJVLAIW-DAAZQVBGSA-N1,2,3,4-tetra-O-acetyl-5-thio-D-xylopyranoseAC-907/250143762,3,5-tris(acetyloxy)tetrahydro-2H-thiopyran-4-yl acetate

Database identifiers

PubChem CID
10991244
Nikkaji
J1.223.990D

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
131 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
8
Heavy atoms
22

Related reactions

4 records
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Linked notes

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