219586-39-7
B-D-GLUCOPYRANOSE, 1-DEOXY-4,6-O-[(R)-PHENYLMETHYLENE]-1-(PHENYLSULFINYL)-, DIBENZOATE
Name
B-D-GLUCOPYRANOSE, 1-DEOXY-4,6-O-[(R)-PHENYLMETHYLENE]-1-(PHENYLSULFINYL)-, DIBENZOATE
Formula
C33H28O8S
MolWeight
584.642
1Identification
【Name】
B-D-GLUCOPYRANOSE, 1-DEOXY-4,6-O-[(R)-PHENYLMETHYLENE]-1-(PHENYLSULFINYL)-, DIBENZOATE
【CAS】
【MDL】
MFCD13182708
【English Synonyms】
【Formula】
C33H28O8S
【MolWeight】
584.642
【Inchi】
InChI=1S/C33H28O8S/c34-30(22-13-5-1-6-14-22)39-28-27-26(21-37-32(41-27)24-17-9-3-10-18-24)38-33(42(36)25-19-11-4-12-20-25)29(28)40-31(35)23-15-7-2-8-16-23/h1-20,26-29,32-33H,21H2/t26-,27-,28+,29-,32-,33+,42?/m1/s1
【InChIKey】
InChIKey=OOACVWMVSCHHGD-XPTFFERZSA-N
【SMILES】
O=C(O[C@@H]1[C@@H](OC(=O)C2=CC=CC=C2)[C@@H](O[C@@H]2CO[C@H](O[C@@H]12)C1=CC=CC=C1)S(=O)C1=CC=CC=C1)C1=CC=CC=C1
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:F