23661-28-1 ,1-Phenyl-1-thio-β-D-glucopyranoside tetraacetate, CAS:23661-28-1

23661-28-1 ,1-Phenyl-1-thio-β-D-glucopyranoside tetraacetate,
CAS:23661-28-1
C20H24O9S / 440.47
MFCD00135159

Phenyl 2,3,4,6-tetra-O-acetyl-b-D-thioglucopyranoside

2,3,4,6-O-四乙酰基-1-硫代-β-D-苯基葡萄糖苷,

Phenyl 2,3,4,6-tetra-O-acetyl-β-D-thioglucopyranoside (PTATG) is a synthetic sugar that is used as a building block in the synthesis of complex carbohydrates. It can be fluorinated to form phenyl 2,3,4,6-tetrafluoro-β-D-thioglucopyranoside (PTFFTG). PTATG and PTFFTG are potential anticancer drugs.

CAS Number	23661-28-1
Product Name	(2R,3R,4S,5R,6S)-2-(Acetoxymethyl)-6-(phenylthio)tetrahydro-2H-pyran-3,4,5-triyl triacetate
IUPAC Name	(3,4,5-triacetyloxy-6-phenylsulfanyloxan-2-yl)methyl acetate
Molecular Formula	C20H24O9S
Molecular Weight	440.47 g/mol
InChI	InChI=1S/C20H24O9S/c1-11(21)25-10-16-17(26-12(2)22)18(27-13(3)23)19(28-14(4)24)20(29-16)30-15-8-6-5-7-9-15/h5-9,16-20H,10H2,1-4H3
InChI Key	JCKOUAWEMPKIAT-OBKDMQGPSA-N
SMILES	CC(=O)OCC1C(C(C(C(O1)SC2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C
Canonical SMILES	CC(=O)OCC1C(C(C(C(O1)SC2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C
Isomeric SMILES	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)SC2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C