3825-18-1 , 氟代-四苯甲酰基-a-D-吡喃甘露糖 , CAS:3825-18-1

3825-18-1 , Tetra-O-benzoyl-a-Dmannopyranosyl fluoride,
氟代-四苯甲酰基-a-D-吡喃甘露糖 ,
CAS: 3825-18-1
C34H27FO9 / 598.58

Tetra-O-benzoyl-a-Dmannopyranosyl fluoride

氟代-四苯甲酰基-a-D-吡喃甘露糖,

CAS Number	3825-18-1
Product Name	a-D-Mannopyranosyl fluoride, tetrabenzoate
IUPAC Name	[(2R,3R,4S,5S,6R)-3,4,5-tribenzoyloxy-6-fluorooxan-2-yl]methyl benzoate
Molecular Formula	C34H27FO9
Molecular Weight	598.58 g/mol
InChI	InChI=1S/C34H27FO9/c35-30-29(44-34(39)25-19-11-4-12-20-25)28(43-33(38)24-17-9-3-10-18-24)27(42-32(37)23-15-7-2-8-16-23)26(41-30)21-40-31(36)22-13-5-1-6-14-22/h1-20,26-30H,21H2/t26-,27-,28+,29+,30+/m1/s1
InChI Key	OWVCLZCQOHOGFK-ZNOUKXQUSA-N
SMILES	C1=CC=C(C=C1)C(=O)OCC2C(C(C(C(O2)F)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5
Canonical SMILES	C1=CC=C(C=C1)C(=O)OCC2C(C(C(C(O2)F)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5
Isomeric SMILES	C1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@@H]([C@H](O2)F)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5