562070-48-8
1-DEOXY-6-O-[(4-METHOXYPHENYL)METHYL]-2,3-BIS-O-(PHENYLMETHYL)-1-(PHENYLSULFINYL)-B-D-GLUCOPYRANOSE
Name
1-DEOXY-6-O-[(4-METHOXYPHENYL)METHYL]-2,3-BIS-O-(PHENYLMETHYL)-1-(PHENYLSULFINYL)-B-D-GLUCOPYRANOSE
Formula
C35H38O7S
MolWeight
602.744
1Identification
【Name】
1-DEOXY-6-O-[(4-METHOXYPHENYL)METHYL]-2,3-BIS-O-(PHENYLMETHYL)-1-(PHENYLSULFINYL)-B-D-GLUCOPYRANOSE
【CAS】
【MDL】
MFCD13182810
【English Synonyms】
【Formula】
C35H38O7S
【MolWeight】
602.744
【Inchi】
InChI=1S/C35H38O7S/c1-25-13-19-30(20-14-25)43(37)35-34(41-23-27-11-7-4-8-12-27)33(40-22-26-9-5-3-6-10-26)32(36)31(42-35)24-39-21-28-15-17-29(38-2)18-16-28/h3-20,31-36H,21-24H2,1-2H3/t31-,32-,33+,34-,35+,43?/m1/s1
【InChIKey】
InChIKey=WYRYPKCOUSKPOU-QOPOIAOLSA-N
【SMILES】
COC1=CC=C(COC[C@H]2O[C@H]([C@H](OCC3=CC=CC=C3)[C@@H](OCC3=CC=CC=C3)[C@@H]2O)S(=O)C2=CC=C(C)C=C2)C=C1
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F