Phenyl 4-O-acetyl-2,6-di-O-benzoyl-1-thio-β-thio-β-D-galactopyranoside

CAS	152488-28-3
Synonyms	β-D-Galactopyranoside, phenyl 1-thio-, 4-acetate 2,6-dibenzoate
IUPAC Name	[(2R,3R,4S,5R,6S)-3-acetyloxy-5-benzoyloxy-4-hydroxy-6-phenylsulfanyloxan-2-yl]methyl benzoate
Molecular Weight	522.57
Molecular Formula	C28H26O8S
Canonical SMILES	CC(=O)O[C@H]1[C@H](O[C@H]([C@@H]([C@H]1O)OC(=O)C2=CC=CC=C2)SC3=CC=CC=C3)COC(=O)C4=CC=CC=C4
InChI	InChI=1S/C28H26O8S/c1-18(29)34-24-22(17-33-26(31)19-11-5-2-6-12-19)35-28(37-21-15-9-4-10-16-21)25(23(24)30)36-27(32)20-13-7-3-8-14-20/h2-16,22-25,28,30H,17H2,1H3/t22-,23+,24+,25-,28+/m1/s1
InChI Key	VHTJDGRGBFUZBL-QTDWVDHPSA-N
Boiling Point	689.5±55.0 °C
Melting Point	93-98 °C
Purity	98%
Density	1.36±0.1 g/ml
Appearance	White powder