GD156430

Name:

[6-({2-[(2-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}-6-{[(4,5-dihydroxy-6-methyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]methyl}-4,5-dihydroxyoxan-3-yl)oxy]-3,5-dihydroxy-6-methyloxan-4-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate

Formula:

C57H72O34

Smiles:

COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2OC(COC3OC(C)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2OC2OC(C)C(O)C(OC3OC(COC(=O)C=Cc4cc(OC)c(O)c(OC)c4)C(O)C(O)C3O)C2O)ccc1O

Aglycone:

COC(=O)C=Cc1cc(OC)c(O)c(OC)c1.COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O

Sugarmoiety:

CC1OC(OCC2OC(O)C(OC3OC(C)C(O)C(OC4OC(O)C(O)C(O)C4O)C3O)C(O)C2O)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O

Other Identifiers

• CNP0183747

AD01682

Formula: C16H12O7

Smiles:

COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O

HBA:	7	RingCount:	3
HBD:	4	FractionCSP3:	0.06
AlogP:	2.29	Num_rotatable_bonds:	2
MolWt:	316.26	Num_heavy_atoms:	23
TPSA:	120.36	NumAromaticRings:	3

AD03982

Formula: C12H14O5

Smiles:

COC(=O)C=Cc1cc(OC)c(O)c(OC)c1

HBA:	5	RingCount:	1
HBD:	1	FractionCSP3:	0.25
AlogP:	1.6	Num_rotatable_bonds:	4
MolWt:	238.24	Num_heavy_atoms:	17
TPSA:	64.99	NumAromaticRings:	1