Catalog Number:
AG004QD0
Chemical Name:
5,7-Bis-(benzyloxy)-α-(4-(benzyloxy)phenyl)-3-[3,4-di-O-acetyl-α-O-acetyl-α-L-rhamnopyranosyloxyl]-4H-chromen-4-one
CAS Number:
849938-27-8
Molecular Formula:
C53H48O12
Molecular Weight:
876.9410
IUPAC Name:
[(2S,3S,4S,5R)-4-acetyloxy-2-methyl-6-[4-oxo-5,7-bis(phenylmethoxy)-2-(4-phenylmethoxyphenyl)chromen-3-yl]oxy-5-phenylmethoxyoxan-3-yl] acetate
InChI:
InChI=1S/C53H48O12/c1-34-48(62-35(2)54)51(63-36(3)55)52(60-33-40-22-14-7-15-23-40)53(61-34)65-50-47(56)46-44(59-32-39-20-12-6-13-21-39)28-43(58-31-38-18-10-5-11-19-38)29-45(46)64-49(50)41-24-26-42(27-25-41)57-30-37-16-8-4-9-17-37/h4-29,34,48,51-53H,30-33H2,1-3H3/t34-,48-,51-,52+,53?/m0/s1
InChI Key:
NJKJOSVFCLXHBI-UOWOZGMLSA-N
SMILES:
CC(=O)O[C@H]1[C@H](C)OC([C@@H]([C@H]1OC(=O)C)OCc1ccccc1)Oc1c(oc2c(c1=O)c(OCc1ccccc1)cc(c2)OCc1ccccc1)c1ccc(cc1)OCc1ccccc1